data_1m62_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1m62 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 56.3 p . . . . . 0 CA--C 1.519 -0.224 0 CA-C-O 120.676 0.274 . . . . 0.0 111.485 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 37.7 mm -58.68 -29.75 40.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.456 ' HA ' HG12 ' A' ' 384' ' ' ILE . 30.4 mttp -56.71 -33.23 66.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -37.95 84.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.078 0.466 . . . . 0.0 110.773 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.44 -34.71 58.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.483 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.456 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.9 -44.68 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.316 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.31 -43.72 88.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.279 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 42.5 t -70.31 -42.91 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.63 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.408 ' O ' ' CG1' ' A' ' 390' ' ' VAL . 0.4 OUTLIER -66.09 -35.09 79.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 179.657 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.86 -34.96 78.45 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -40.85 87.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.548 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . 0.583 HG13 ' N ' ' A' ' 391' ' ' GLN . 4.3 p -63.59 -35.54 73.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.583 ' N ' HG13 ' A' ' 390' ' ' VAL . 1.0 OUTLIER -62.41 -40.97 98.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.513 179.655 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -70.44 -35.53 73.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.504 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.22 -38.56 90.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.516 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.66 -46.88 87.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.543 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.96 -32.52 73.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.603 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -38.25 78.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 21.7 t -60.69 -41.98 90.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.858 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -55.63 -34.55 65.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.02 0.438 . . . . 0.0 110.468 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -84.45 -54.34 4.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.153 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.584 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.8 t80 -27.42 112.55 0.06 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.001 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.9 p -105.13 26.81 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.53 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.584 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -57.64 -170.22 0.18 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.173 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.95 143.88 48.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.217 -0.492 . . . . 0.0 111.486 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -30.56 3.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.068 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.8 t -115.48 15.77 16.68 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 0.3 OUTLIER -83.11 150.49 26.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.871 0.367 . . . . 0.0 110.859 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -63.41 -30.66 71.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.213 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -73.17 -38.86 66.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.967 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.535 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 16.7 t80 -60.12 -44.36 94.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.566 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.471 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -58.92 -48.82 80.1 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.653 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.577 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -64.27 -38.05 89.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.421 ' HG ' ' CD2' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.58 -47.56 85.08 Favored 'General case' 0 CA--C 1.523 -0.089 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -32.64 69.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.223 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.18 -46.4 84.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.233 -179.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 17.3 ptp -62.85 -40.37 97.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.816 0.341 . . . . 0.0 110.861 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.407 ' O ' ' CG ' ' A' ' 419' ' ' GLU . 1.3 mt -63.33 -48.15 79.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.449 . . . . 0.0 110.541 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.7 m -64.82 -30.39 71.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -62.19 -47.3 85.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.129 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.407 ' CG ' ' O ' ' A' ' 416' ' ' LEU . 3.8 pt-20 -63.58 -34.81 78.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.027 0.442 . . . . 0.0 110.14 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.402 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 0.4 OUTLIER -69.01 -33.94 74.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.037 179.217 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.4 mp -70.34 -31.87 69.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.995 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.44 -46.38 60.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.814 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.47 -30.82 69.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.96 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -92.68 29.74 1.7 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.217 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.3 t -109.24 -17.16 13.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.958 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 13.5 m -66.59 137.34 25.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.12 -46.75 11.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.947 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 14.8 t 45.47 -167.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.358 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -169.65 -51.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.577 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.94 36.18 2.1 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.494 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -103.84 103.27 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.906 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.5 -39.69 85.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -40.95 86.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 39.1 t -69.8 -46.28 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.165 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -39.33 83.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.012 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -69.15 -45.12 70.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.141 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -69.11 -37.58 78.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.291 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -44.55 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.052 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 34.1 tttp -67.96 -43.17 79.64 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.197 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -64.08 -39.41 94.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.1 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.59 86.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.22 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 20.3 t -62.64 -35.45 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.86 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 6.8 m -63.08 -36.05 82.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.436 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -64.39 -41.71 96.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.706 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.36 -31.17 51.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -41.73 90.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.691 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.19 91.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.071 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 34.0 mt -73.61 -36.53 47.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.142 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -44.76 85.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.971 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.12 -40.93 67.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.852 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -30.93 66.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 110.067 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -36.64 51.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.565 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -56.15 -30.0 61.55 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.805 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 10.5 pttt -90.37 -16.58 28.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.266 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -82.46 -23.5 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.668 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.57 -91.87 0.23 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.478 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.873 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 CA--C 1.519 -0.234 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 36.8 mm -58.65 -30.06 40.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -56.8 -33.26 66.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -68.38 -39.85 81.61 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 111.218 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . 0.432 ' O ' ' HB2' ' A' ' 387' ' ' LEU . 4.4 mt -60.6 -31.79 49.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.673 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.435 HD11 ' N ' ' A' ' 384' ' ' ILE . 0.4 OUTLIER -74.77 -44.3 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.44 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.16 178.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -56.37 -46.19 80.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.279 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 96.6 t -68.44 -37.3 77.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.138 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 383' ' ' ILE . 0.2 OUTLIER -67.52 -35.19 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.256 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -62.8 -35.0 78.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.67 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -38.81 88.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.285 179.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 24.2 t -69.74 -35.89 67.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.635 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -40.87 83.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.655 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -40.77 84.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.456 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -40.99 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.498 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -59.86 -35.33 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -49.2 74.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -69.25 -45.11 70.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.99 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . 0.407 HG12 ' CD1' ' A' ' 452' ' ' LEU . 23.6 t -61.38 -32.3 52.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 110.542 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -56.66 -37.05 70.26 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.239 0.543 . . . . 0.0 109.861 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -86.73 -67.7 0.8 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.671 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.531 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 4.0 t80 58.92 142.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.142 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 18.0 t -123.92 20.68 4.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.093 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.531 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -115.89 178.57 17.62 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.402 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.471 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -134.19 157.03 47.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.884 0.373 . . . . 0.0 111.603 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.586 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.5 -31.71 56.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.661 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.6 t -89.77 9.48 27.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.791 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.471 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 1.8 m-20 -115.09 164.81 13.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.336 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.715 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.8 mmtm -69.66 -29.87 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.482 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -62.54 -29.23 70.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.579 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.586 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 22.9 t80 -71.64 -45.89 60.68 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.129 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.715 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.9 OUTLIER -73.14 -31.59 64.37 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.716 177.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.604 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.3 tp -67.8 -38.41 83.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.046 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.455 ' CD2' ' CG ' ' A' ' 400' ' ' PHE . 21.3 tp -60.85 -47.28 87.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -70.67 -32.02 69.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.795 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.604 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.57 -46.21 86.95 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.008 -179.112 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -64.49 -37.56 87.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.977 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 5.0 tp -65.95 -37.19 85.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.253 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 29.8 m -62.53 -40.35 96.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.888 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -60.52 -47.31 86.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.854 0.359 . . . . 0.0 110.489 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -72.17 -35.83 69.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.2 0.524 . . . . 0.0 109.809 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 0.1 OUTLIER -61.97 -39.56 92.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.979 179.162 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.72 -31.79 68.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.073 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.04 -46.52 89.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.193 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 420' ' ' LEU . 4.0 pp -74.45 -30.97 62.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -98.81 30.95 3.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.859 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.2 t -108.25 -16.01 14.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 5.6 m -66.53 127.34 27.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.864 0.364 . . . . 0.0 111.123 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -84.79 -41.73 15.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.9 p 55.89 -174.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.021 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -178.05 50.64 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.22 -28.92 4.21 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.454 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.17 92.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.31 -35.61 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 20.5 p -61.81 -38.71 89.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 31.0 t -76.07 -36.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.056 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -40.99 94.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.88 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -69.22 -36.69 77.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.21 -45.1 58.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.417 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 439' ' ' LYS . 0.0 OUTLIER -65.17 -39.77 93.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.936 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 438' ' ' ARG . 0.0 OUTLIER -63.99 -43.42 95.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.601 179.818 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -32.31 71.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.696 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . 0.442 ' O ' HG12 ' A' ' 445' ' ' ILE . . . -66.9 -45.45 77.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.194 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.532 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 23.2 t -62.89 -30.78 50.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.111 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 4.0 t -67.35 -40.64 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.917 0.389 . . . . 0.0 110.48 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -44.73 78.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.087 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.532 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 9.4 pt -65.35 -31.23 52.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.916 0.388 . . . . 0.0 110.873 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.18 -47.78 84.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.725 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.67 80.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 21.4 mt -66.88 -36.6 77.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.718 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.45 -51.52 69.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.675 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -61.93 -30.47 70.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 110.336 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.39 75.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.075 0.464 . . . . 0.0 109.992 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.412 ' CD2' HD21 ' A' ' 412' ' ' LEU . 4.9 mp -70.81 -36.8 73.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.287 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -56.16 -29.84 61.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.187 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -101.19 -16.57 16.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.544 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -22.23 35.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.709 0.29 . . . . 0.0 110.95 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.36 -86.39 0.61 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.381 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.881 179.943 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.518 -0.259 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . 0.475 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.8 mm -58.65 -29.76 40.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 2.1 mmpt? -56.71 -32.97 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.103 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -66.1 -41.98 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.941 0.401 . . . . 0.0 111.529 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . 0.479 HG22 ' N ' ' A' ' 384' ' ' ILE . 7.8 tp -60.57 -31.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.547 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.479 ' N ' HG22 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.91 -44.82 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.696 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -58.56 -49.35 77.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.809 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.9 p -64.1 -42.89 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.8 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -33.5 76.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.681 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.87 -34.82 78.18 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.947 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.15 -43.38 87.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.487 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 28.0 t -61.97 -35.97 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.853 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.01 -41.07 97.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.808 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -68.27 -42.2 79.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.77 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.26 -38.22 85.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.717 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -60.38 -45.64 92.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.724 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -60.94 -35.68 77.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.808 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -69.34 -39.93 77.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.006 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 9.0 t -60.62 -39.71 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.842 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -40.31 72.04 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.435 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -76.88 -54.27 6.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.101 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.672 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.5 t80 -24.3 113.11 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.051 -0.977 . . . . 0.0 113.222 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 p -104.71 28.11 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.351 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.672 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -50.58 -179.96 0.03 OUTLIER Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.87 -0.605 . . . . 0.0 113.411 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.88 143.51 48.33 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.708 -0.746 . . . . 0.0 111.636 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -20.46 43.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.493 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.2 m -101.87 -14.33 17.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.751 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.409 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 23.7 t70 -77.47 151.44 34.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.769 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.9 OUTLIER -71.29 -32.02 68.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 179.788 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.89 -29.1 70.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.342 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.529 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 29.8 t80 -64.23 -45.4 88.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.797 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.769 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.3 p-90 -72.82 -27.84 62.2 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 118.826 -1.149 . . . . 0.0 108.677 177.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.3 mp -67.59 -41.37 84.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.521 177.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.466 ' HG ' ' CD2' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -61.35 -47.21 86.91 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.285 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -70.49 -32.37 69.85 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.483 177.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.83 -43.42 96.25 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.721 -179.676 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 18.7 ttt -69.66 -41.37 75.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.266 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -37.21 85.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.721 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 417' ' ' THR . . . . . 0.423 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 85.0 m -67.71 -30.31 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.91 -38.4 72.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.441 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 5.4 pt-20 -70.78 -37.95 73.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.556 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.424 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 4.2 pp -72.97 -33.32 65.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 110.851 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . 0.4 ' N ' ' CD1' ' A' ' 420' ' ' LEU . 1.1 tp -68.49 -32.24 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -71.1 -39.48 72.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.793 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 3.0 mt -58.56 -31.74 68.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.833 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.13 -25.04 17.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.082 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 38.3 t -55.44 -31.02 61.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.023 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 7.6 m -74.68 120.87 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.109 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -88.4 143.15 27.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 27.1 p -131.23 -170.51 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.883 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -147.86 -90.58 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.516 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -96.45 29.76 9.79 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 89.82 4.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -40.05 96.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.809 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.3 t -60.0 -41.03 91.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.827 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 32.1 t -71.4 -35.61 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.978 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . 0.415 ' HA ' ' HD3' ' A' ' 438' ' ' ARG . 0.1 OUTLIER -64.5 -43.54 93.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.716 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -69.19 -32.85 72.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.871 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.33 -45.13 61.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.863 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' ' 435' ' ' ARG . 14.5 ptm180 -64.12 -44.55 91.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.572 0.225 . . . . 0.0 111.333 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' A' ' 440' ' ' GLU . 1.5 pttt -63.72 -32.87 74.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.903 0.382 . . . . 0.0 110.576 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . 0.434 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 4.7 mm-40 -67.75 -31.24 71.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.533 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.2 73.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.798 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.559 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 21.2 t -62.86 -34.13 64.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 66.0 m -70.7 -43.52 68.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.732 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.87 -44.75 69.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.009 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.559 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.3 pp -63.89 -31.13 51.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.107 0.48 . . . . 0.0 110.697 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -39.88 90.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.341 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.56 81.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.055 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 19.3 mt -72.67 -38.33 58.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.76 -48.52 79.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.635 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -70.18 -37.17 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.638 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.89 -31.27 66.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.082 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.418 HD21 ' CE2' ' A' ' 400' ' ' PHE . 0.1 OUTLIER -76.23 -36.74 58.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.444 179.351 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.74 -29.91 65.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.602 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.11 -13.46 28.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.248 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -24.24 34.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.809 0.338 . . . . 0.0 110.6 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -79.11 -80.61 0.75 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.368 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.255 -0.878 . . . . 0.0 110.862 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 N--CA 1.462 0.143 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.4 mm -58.85 -30.09 41.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.229 0.538 . . . . 0.0 109.691 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 20.2 pttt -56.66 -33.01 65.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.932 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -65.07 -42.96 93.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.589 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . 0.495 HG22 ' N ' ' A' ' 384' ' ' ILE . 0.8 OUTLIER -60.57 -32.04 50.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.495 ' N ' HG22 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.88 -44.76 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.545 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -56.69 -47.31 80.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.692 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 37.2 t -65.43 -34.5 70.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.669 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.44 82.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.49 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -34.64 77.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.581 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -34.67 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.438 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 28.2 t -67.08 -46.76 83.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.019 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.36 -40.93 92.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.5 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -68.52 -38.77 81.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.302 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.91 -37.9 89.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.323 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -58.86 -44.0 90.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.457 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.5 -39.64 88.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.694 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -69.24 -40.05 78.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . 0.405 ' CG1' ' CG2' ' A' ' 448' ' ' ILE . 23.7 t -60.63 -36.98 74.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.68 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -38.31 70.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.203 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.501 ' O ' ' C ' ' A' ' 400' ' ' PHE . 18.2 tt0 -79.84 -55.46 4.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.043 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.593 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 20.4 t80 -4.71 109.12 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.404 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 23.3 m -101.47 25.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.692 178.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.593 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -67.36 -173.59 6.53 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.843 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.0 143.74 48.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.305 -0.447 . . . . 0.0 111.496 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.444 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -57.27 -24.3 53.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.903 179.147 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 7.6 m -103.84 13.33 33.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.204 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.71 149.24 28.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.791 0.329 . . . . 0.0 110.687 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.764 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.16 -30.09 70.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.97 0.414 . . . . 0.0 110.9 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.78 -29.15 70.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.012 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.46 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 3.0 t80 -68.01 -45.56 73.68 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.764 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.13 63.84 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.691 177.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.569 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -66.44 -40.05 89.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.423 177.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.425 ' HG ' ' CG ' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -60.83 -47.25 87.21 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.117 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.435 ' HA ' ' CD2' ' A' ' 416' ' ' LEU . 0.9 OUTLIER -70.73 -32.27 69.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.729 177.811 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.569 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.85 -45.26 90.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.636 -179.165 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.468 ' HA ' ' HG2' ' A' ' 418' ' ' LYS . 21.4 ptp -66.45 -44.79 81.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.748 0.309 . . . . 0.0 111.136 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.435 ' CD2' ' HA ' ' A' ' 413' ' ' GLU . 4.1 pp -69.26 -37.13 77.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.831 0.348 . . . . 0.0 111.073 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 98.5 m -73.61 -44.03 58.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.679 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -58.01 -37.96 75.25 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.599 -179.627 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.431 ' N ' ' HG3' ' A' ' 418' ' ' LYS . 19.0 pt-20 -72.27 -34.8 68.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.206 0.527 . . . . 0.0 109.651 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.98 -44.13 85.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.446 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.63 -34.07 75.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.78 -39.46 94.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.433 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 6.7 mt -60.21 -35.17 74.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.789 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.24 -28.85 57.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.061 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.3 m -57.01 -34.87 68.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.962 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.06 120.15 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.0 158.13 8.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.992 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 72.3 p -122.71 -72.69 0.67 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 71.9 -100.47 0.93 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.551 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -118.71 72.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.21 108.8 1.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.902 0.382 . . . . 0.0 110.823 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.57 -28.63 67.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.397 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.8 m -57.54 -44.97 85.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.685 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.11 -35.48 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.147 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -44.43 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.872 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -35.8 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.777 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.96 -32.13 65.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.99 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.72 -42.45 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.354 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 -36.64 84.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.567 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -42.57 99.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.81 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.57 92.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.915 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.55 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 22.2 t -63.96 -31.64 54.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.909 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 97.9 m -70.7 -46.78 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.924 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -44.76 76.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.55 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.4 pp -64.14 -31.13 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.792 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -46.58 88.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.152 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -63.08 -36.03 82.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.684 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . 0.405 ' CG2' ' CG1' ' A' ' 397' ' ' VAL . 17.6 mt -73.14 -36.54 50.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.806 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.49 -49.26 76.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.702 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -41.87 66.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.416 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.9 mmtp -57.88 -30.01 65.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.083 0.468 . . . . 0.0 110.007 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.72 -36.72 56.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.438 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -56.98 -29.9 63.65 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -96.52 -11.16 25.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.477 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.56 -24.69 33.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -94.66 -71.34 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.416 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.935 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.518 -0.26 0 CA-C-O 120.697 0.284 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 3.2 mt -58.71 -29.77 40.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.434 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -56.8 -33.17 66.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.978 -179.815 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.48 -38.03 83.77 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.135 0.493 . . . . 0.0 110.745 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 40.8 mm -60.44 -33.58 54.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.63 178.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.4 OUTLIER -74.74 -44.41 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.411 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -56.57 -45.12 81.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 57.8 t -66.13 -39.63 84.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.162 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.58 -32.57 73.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.292 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -35.14 79.18 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -38.06 74.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.184 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.9 p -70.38 -37.7 71.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.582 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.416 ' N ' HG11 ' A' ' 390' ' ' VAL . 15.6 pt20 -66.9 -40.97 87.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.841 0.353 . . . . 0.0 110.624 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -40.75 75.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.468 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.04 -38.65 89.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.426 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -59.63 -47.32 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.676 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -36.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.659 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -69.32 -37.5 77.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.096 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 25.6 t -60.53 -45.64 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.218 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -55.49 -31.92 62.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.915 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -87.4 -54.39 4.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.52 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.662 ' CZ ' ' HA2' ' A' ' 402' ' ' GLY . 4.1 t80 -48.11 113.54 0.76 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.741 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . 0.468 ' O ' ' O ' ' A' ' 402' ' ' GLY . 28.7 m -47.68 -31.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.881 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.662 ' HA2' ' CZ ' ' A' ' 400' ' ' PHE . . . 37.4 106.7 0.01 OUTLIER Glycine 0 C--O 1.228 -0.264 0 N-CA-C 114.679 0.632 . . . . 0.0 114.679 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.25 143.0 48.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.039 0.447 . . . . 0.0 110.893 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.472 ' HG2' ' CB ' ' A' ' 457' ' ' LEU . 0.2 OUTLIER -60.09 -22.18 62.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.217 179.764 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.99 1.1 51.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.35 135.64 53.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.917 0.389 . . . . 0.0 110.564 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.695 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 10.9 mtmt -61.01 -29.87 69.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.641 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 412' ' ' LEU . . . -62.71 -28.97 70.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.054 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 38.5 t80 -67.23 -45.85 75.55 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.695 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -73.05 -30.27 63.59 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 118.824 -1.15 . . . . 0.0 108.934 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.566 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.0 tp -69.63 -38.45 77.22 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.743 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.461 ' CD2' ' CD2' ' A' ' 400' ' ' PHE . 0.3 OUTLIER -62.31 -47.16 85.49 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -70.64 -32.81 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.408 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.1 mt-10 -64.1 -43.6 94.85 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.824 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 39.2 ttm -69.59 -35.26 75.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.659 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 11.3 tp -63.41 -48.08 79.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.818 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 52.7 m -65.01 -30.46 71.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.066 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -47.34 85.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.259 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 2.9 pt-20 -67.21 -36.16 81.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.406 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 3.1 tm? -67.74 -34.64 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.001 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.22 -31.9 69.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -43.0 98.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.772 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -31.15 58.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.014 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -76.64 -14.19 60.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 5.8 m -84.58 -25.79 28.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.768 0.318 . . . . 0.0 111.143 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.6 137.73 24.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.167 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.9 164.55 25.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.0 t -178.48 126.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.71 -84.97 1.78 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.439 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.89 38.09 1.86 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.473 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . 0.403 ' HB3' HG21 ' A' ' 434' ' ' VAL . 0.5 OUTLIER -91.77 123.82 35.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 110.892 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -67.69 -28.65 67.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.076 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.6 t -67.17 -44.85 78.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.675 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . 0.403 HG21 ' HB3' ' A' ' 431' ' ' GLN . 21.4 m -75.47 -37.59 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.733 0.301 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 40.1 mtt180 -67.66 -44.65 77.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.911 0.386 . . . . 0.0 110.697 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -69.41 -34.46 74.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.94 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.24 -45.22 57.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.513 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -39.12 92.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.781 0.324 . . . . 0.0 110.884 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -35.21 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.529 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.38 -35.89 80.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.09 -45.43 93.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.897 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.533 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 24.3 t -62.96 -33.29 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.752 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.2 m -70.73 -45.23 65.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.506 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -44.65 77.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.062 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.533 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.8 pp -63.37 -31.03 51.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -65.1 -41.54 94.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.508 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.49 -40.2 92.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 41.6 mt -67.7 -36.66 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -46.99 83.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.698 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -40.58 68.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.536 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -30.6 66.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.025 0.44 . . . . 0.0 109.967 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.59 -36.76 51.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.264 179.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.5 -29.94 69.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.629 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -86.64 -18.8 30.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.427 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 402' ' ' GLY . 0.0 OUTLIER -82.25 -25.93 33.65 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.453 ' O ' ' CD1' ' A' ' 457' ' ' LEU . . . -130.42 -115.96 1.8 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . 0.472 ' CB ' ' HG2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.03 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 66.0 m . . . . . 0 CA--C 1.52 -0.179 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 43.8 mm -58.63 -29.77 40.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.434 ' HA ' HG12 ' A' ' 384' ' ' ILE . 27.3 mtmm -56.92 -33.16 66.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.06 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -67.92 -37.97 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.133 0.492 . . . . 0.0 110.694 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 37.5 mt -60.55 -33.6 55.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.41 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.77 -44.65 45.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.237 178.477 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -49.38 77.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.669 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 14.5 p -65.47 -45.02 94.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.38 -33.41 75.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.8 -35.05 78.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.741 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.38 -40.26 93.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.286 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 24.6 t -64.35 -37.01 78.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 -41.15 89.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -63.42 -38.52 91.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.455 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -38.03 89.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.93 -42.79 90.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.639 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.95 -40.3 92.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -69.12 -45.26 70.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.777 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 23.1 t -60.65 -36.91 73.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.705 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -58.42 -40.36 82.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.101 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -84.16 -67.55 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.577 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 18.6 t80 21.96 107.83 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 20.4 t -95.79 25.93 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.065 178.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.577 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -84.88 -176.8 50.95 Favored Glycine 0 N--CA 1.441 -0.99 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.732 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.25 143.81 48.02 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.404 -0.398 . . . . 0.0 111.628 -179.73 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.479 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -58.6 -23.52 58.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.82 0.343 . . . . 0.0 110.867 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 16.1 p -101.99 12.96 36.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.104 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.64 153.5 26.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.8 0.334 . . . . 0.0 110.873 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.801 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.2 mttt -61.15 -30.1 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.899 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.73 -29.19 70.49 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.508 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.479 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 3.7 t80 -72.06 -45.67 59.86 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.801 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -73.07 -29.36 62.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 118.841 -1.144 . . . . 0.0 108.9 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.551 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 15.8 tp -69.68 -41.32 75.61 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.428 178.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.465 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 8.0 tp -61.07 -46.71 89.56 Favored 'General case' 0 C--N 1.34 0.168 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 1.1 tt0 -70.2 -32.16 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.602 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.559 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 0.5 OUTLIER -63.9 -37.78 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.83 -179.652 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 5.9 ttt -69.75 -44.57 69.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.173 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 413' ' ' GLU . 4.4 pp -68.88 -37.01 78.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.791 0.329 . . . . 0.0 110.843 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 417' ' ' THR . . . . . 0.421 ' N ' ' CD1' ' A' ' 416' ' ' LEU . 90.4 m -62.58 -33.57 75.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.493 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -66.35 -47.46 73.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.138 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.51 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 0.3 OUTLIER -69.77 -34.7 74.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.51 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 6.2 tt -59.6 -44.42 93.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.864 178.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.51 -31.82 69.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.354 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.67 -46.88 87.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.427 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 420' ' ' LEU . 1.7 pp -74.55 -31.06 61.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.797 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.78 -19.46 61.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.116 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 35.5 t -95.3 35.38 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.197 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 34.1 m -97.78 131.92 43.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.127 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -91.85 128.15 37.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.1 t -113.94 145.31 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.92 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.29 66.46 0.55 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.439 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.35 74.49 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.495 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -97.22 114.03 25.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 0.0 110.844 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.79 -31.58 72.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 18.5 t -63.48 -44.42 94.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 21.8 t -68.47 -38.94 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.116 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -44.61 96.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.884 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -69.23 -35.64 76.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.851 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.19 -37.02 66.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.181 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.7 -44.69 61.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -34.09 75.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.879 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.13 -41.76 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . 0.448 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -63.75 -45.73 88.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.339 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 34.0 t -63.82 -32.81 58.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.873 0.368 . . . . 0.0 110.854 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.88 -43.57 98.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.588 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.21 -37.78 88.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 441' ' ' ALA . 14.7 mt -63.26 -33.21 59.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.106 0.479 . . . . 0.0 110.575 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.22 -47.72 83.19 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.752 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.58 70.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.862 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 41.6 mt -62.52 -37.07 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.643 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -52.93 63.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.647 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -39.53 86.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.525 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.4 ttpp -57.89 -30.12 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.209 0.528 . . . . 0.0 109.729 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.465 HD12 ' CE2' ' A' ' 400' ' ' PHE . 36.4 tp -72.82 -36.43 67.53 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.416 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.91 -29.9 60.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.221 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.36 -22.8 32.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.198 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.37 -21.89 35.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -69.07 -99.98 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.401 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.923 179.968 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 24.0 m . . . . . 0 CA--C 1.519 -0.225 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 31.3 mm -58.71 -29.87 40.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.426 ' HA ' HG12 ' A' ' 384' ' ' ILE . 15.2 mtmt -56.96 -33.26 66.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.82 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -67.62 -38.02 83.33 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.128 0.489 . . . . 0.0 110.763 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 24.8 mt -60.48 -34.01 56.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.449 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.426 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.66 -44.78 46.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.204 178.445 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -48.53 81.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.468 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 14.5 p -67.45 -45.88 84.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.5 tt -64.59 -33.62 76.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.378 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -62.68 -35.06 78.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.704 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -39.18 91.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.1 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 40.5 t -66.81 -36.03 76.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.413 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -40.97 85.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.582 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -48.0 76.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.47 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 4.9 tt -60.88 -38.09 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.406 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -39.32 83.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.379 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -61.48 -40.51 94.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.427 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -68.11 -40.89 82.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.638 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.67 -30.5 47.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.693 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -61.99 -36.82 82.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.188 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -87.48 -67.75 0.8 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.215 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.562 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 5.5 t80 56.13 159.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.423 0.63 . . . . 0.0 111.915 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 m -142.26 20.49 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.056 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.562 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -108.18 -172.68 21.7 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.799 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.442 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.08 144.53 48.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.718 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.538 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.77 -28.6 15.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.124 179.238 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.7 t -102.68 15.89 28.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -115.44 157.69 23.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.92 0.39 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.813 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.8 tmtt? -61.18 -30.09 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.963 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.85 -29.13 70.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.632 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.538 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 11.0 t80 -75.18 -45.9 37.64 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.813 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -73.1 -31.99 64.69 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.68 -1.208 . . . . 0.0 108.61 177.779 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 38.7 tp -65.67 -41.11 92.84 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.093 177.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.474 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 30.4 tp -59.66 -46.73 88.14 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.18 -31.72 69.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.773 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.9 tm-20 -63.28 -43.39 98.04 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.983 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 9.7 mmt -67.06 -40.18 87.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 109.664 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.11 -37.36 82.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.645 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 3.6 m -62.84 -42.18 99.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.884 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -47.22 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.844 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 3.9 pt-20 -70.85 -34.78 72.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.372 . . . . 0.0 110.125 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.47 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 1.2 tt -61.61 -45.1 95.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.122 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.4 tp -70.21 -31.88 69.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.785 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -58.9 -46.29 88.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.837 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 1.2 mt -59.54 -31.42 69.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.806 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -100.47 29.18 4.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.913 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 57.6 m -107.96 -29.22 9.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 15.0 m -66.54 133.5 31.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.08 166.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.8 t -156.67 -45.84 0.07 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.914 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 75.01 -69.28 1.9 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.444 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -164.5 40.71 0.3 Allowed Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.425 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -96.38 119.56 35.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -63.11 -31.45 72.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.859 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.7 m -67.65 -42.38 82.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.939 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 26.2 t -73.44 -43.46 55.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . 0.418 ' O ' ' HG3' ' A' ' 438' ' ' ARG . 4.7 mtt180 -59.21 -40.64 86.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.752 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -69.4 -34.58 74.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.892 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.77 -45.34 61.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.634 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 435' ' ' ARG . 0.2 OUTLIER -66.33 -35.06 79.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.389 . . . . 0.0 110.602 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -34.25 77.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -67.33 -37.0 82.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.76 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -61.95 -45.53 93.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.058 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.538 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 31.5 t -63.32 -32.76 57.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.788 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -46.79 62.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.023 0.44 . . . . 0.0 110.815 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.73 88.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.046 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.538 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 1.9 pp -63.37 -31.15 51.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.99 0.424 . . . . 0.0 110.609 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.32 -47.7 84.89 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.837 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.74 -35.85 79.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 41.6 mt -70.16 -36.4 67.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.861 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -48.33 79.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.72 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -39.71 91.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.24 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -57.77 -30.1 65.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.166 0.508 . . . . 0.0 109.692 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.4 ' CG ' HD21 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -72.08 -37.28 69.64 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.378 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -58.07 -29.91 65.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.63 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -91.01 -15.07 30.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.485 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -24.41 34.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.884 0.373 . . . . 0.0 110.583 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.32 -86.58 0.35 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.262 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.774 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.465 0.32 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 24.8 mm -58.62 -29.38 39.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.422 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.55 -33.31 66.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.008 -179.715 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -68.24 -38.09 81.48 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.224 0.535 . . . . 0.0 110.65 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 47.7 mt -60.49 -33.97 56.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.531 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.78 -44.63 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.348 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -56.8 -48.44 77.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.323 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 13.5 p -66.41 -36.3 77.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.652 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.34 -35.93 80.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.43 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . 0.4 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 4.4 mt-10 -62.79 -34.95 78.33 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -34.65 72.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.54 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.4 t -70.4 -46.17 71.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.283 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 388' ' ' GLU . 14.5 pt20 -58.32 -38.8 77.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.683 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.78 -43.42 98.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.78 -38.55 82.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.47 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -39.88 83.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.602 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -45.39 92.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.637 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -69.29 -44.26 72.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.76 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . 0.403 ' CG1' HD12 ' A' ' 452' ' ' LEU . 28.0 t -60.61 -31.38 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.507 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -60.38 -36.37 77.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.206 0.527 . . . . 0.0 109.928 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.48 ' O ' ' O ' ' A' ' 400' ' ' PHE . 5.2 tt0 -90.73 -69.03 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.926 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.524 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 10.2 t80 36.47 109.0 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.118 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 27.8 m -94.81 25.44 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.107 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.524 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.07 -174.46 43.83 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.707 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.81 143.61 48.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.574 -0.313 . . . . 0.0 111.413 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.521 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -56.69 -23.71 44.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.549 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.68 10.15 36.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.308 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.47 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 0.1 OUTLIER -101.93 150.58 23.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.841 0.353 . . . . 0.0 110.474 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.778 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 pptp? -61.13 -30.2 70.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.85 -29.23 70.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.24 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.6 t80 -69.69 -45.6 67.91 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.778 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 5.5 p-90 -72.87 -30.53 64.05 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.902 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.599 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 26.0 tp -69.69 -38.43 77.01 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.418 177.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.467 HD22 ' CE2' ' A' ' 400' ' ' PHE . 9.7 tp -61.53 -47.19 86.72 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 2.0 mt-10 -70.5 -32.52 70.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.483 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.599 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mm-40 -65.51 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.001 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.67 -44.49 70.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.025 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 413' ' ' GLU . 4.3 pp -68.86 -37.05 78.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.782 0.325 . . . . 0.0 110.734 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 59.7 m -64.15 -38.97 92.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.621 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -47.28 86.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -68.53 -34.75 76.42 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.408 ' CD1' HD12 ' A' ' 445' ' ' ILE . 0.3 OUTLIER -60.79 -40.88 94.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.048 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.3 tp -69.4 -31.83 70.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.54 -38.32 87.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -31.23 68.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.792 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.83 27.8 5.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.5 t -100.11 -29.75 12.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 4.3 m -93.77 123.79 46.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 154.58 22.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.985 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 88.4 m -111.19 -64.39 1.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 108.89 -121.9 6.37 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.442 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -106.01 36.14 4.59 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.395 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -106.9 100.19 9.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.835 0.35 . . . . 0.0 110.921 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.14 -33.93 76.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 4.1 t -60.99 -44.83 96.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 28.9 t -70.31 -42.45 78.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.152 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -59.62 -40.69 88.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.827 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.31 -41.78 98.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.05 89.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.978 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.67 -44.51 81.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.759 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -67.95 -39.73 83.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.682 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -71.19 -36.57 71.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.781 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.73 -45.54 82.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.001 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.455 ' HA ' ' CD1' ' A' ' 445' ' ' ILE . 38.6 t -64.58 -33.05 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.024 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 9.4 m -60.89 -43.98 97.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.17 -36.31 83.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.332 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.455 ' CD1' ' HA ' ' A' ' 442' ' ' VAL . 30.0 mt -63.93 -31.23 52.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -42.54 83.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.145 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.83 78.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.726 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 45.2 mt -65.07 -36.46 77.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.712 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -54.3 48.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.867 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -42.12 88.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.393 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -29.96 65.37 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.403 HD12 ' CG1' ' A' ' 397' ' ' VAL . 0.1 OUTLIER -68.73 -38.24 80.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.289 179.152 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.77 -29.85 65.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.896 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.92 -23.57 25.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.221 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -20.06 37.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.775 0.321 . . . . 0.0 110.734 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -67.85 -86.73 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.026 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.894 179.852 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 120.588 0.232 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 42.5 mm -58.72 -29.66 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.446 ' HA ' HG12 ' A' ' 384' ' ' ILE . 16.9 mttt -56.74 -33.12 66.24 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -66.41 -38.04 86.56 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.204 0.526 . . . . 0.0 110.694 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 54.5 mt -60.5 -34.76 59.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.398 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.96 -44.58 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.224 178.392 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -56.65 -37.39 70.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.398 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 68.5 t -73.52 -40.69 55.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.484 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.524 ' O ' HG12 ' A' ' 390' ' ' VAL . 1.2 tt -67.57 -37.54 82.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.327 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.94 -34.93 78.51 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -44.48 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.083 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.5 p -63.18 -41.19 91.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.426 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.42 ' N ' HG11 ' A' ' 390' ' ' VAL . 11.9 pt20 -63.28 -37.95 89.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.991 0.424 . . . . 0.0 110.433 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -72.47 -39.83 67.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.427 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.11 -42.48 99.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.89 92.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.713 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -62.21 -35.37 78.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.662 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.28 -42.43 75.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.826 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 14.5 t -60.66 -32.45 51.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.666 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -61.2 -36.16 79.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.96 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.503 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.9 tt0 -91.78 -68.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.993 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.458 ' CG ' HD22 ' A' ' 412' ' ' LEU . 6.6 t80 45.02 -84.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.714 -0.675 . . . . 0.0 112.611 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 399' ' ' GLU . 5.7 t 78.35 28.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.508 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -98.57 -150.76 26.35 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.501 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.63 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.44 171.09 14.54 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 120.439 0.162 . . . . 0.0 110.598 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -91.0 -10.17 43.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.58 0.228 . . . . 0.0 111.155 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 30.8 p -115.73 -15.55 11.32 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 18.2 t70 -61.54 162.37 8.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.887 0.375 . . . . 0.0 111.341 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.723 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.36 -38.42 71.57 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.627 179.671 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.69 -29.02 70.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.655 178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.63 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 60.4 t80 -57.5 -45.4 84.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.926 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.723 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.58 -29.44 63.53 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 118.865 -1.134 . . . . 0.0 108.663 178.15 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.553 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -65.16 -39.34 92.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.356 177.835 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.458 HD22 ' CG ' ' A' ' 400' ' ' PHE . 8.3 tp -61.42 -47.04 87.58 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 30.6 tt0 -70.49 -32.27 69.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.688 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -64.02 -39.8 94.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.137 -179.426 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 41.2 ttm -69.74 -44.68 69.77 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.292 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 413' ' ' GLU . 4.0 pp -68.75 -38.54 80.18 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.766 0.317 . . . . 0.0 110.683 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 84.8 m -64.32 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.194 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . 0.477 ' O ' HD13 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -66.01 -42.36 89.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.294 179.509 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.59 -36.65 68.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.318 0.58 . . . . 0.0 110.038 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.2 OUTLIER -67.77 -49.26 63.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.833 -179.361 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . 0.481 ' CD1' ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -69.74 -31.53 69.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.138 -0.225 . . . . 0.0 111.355 -178.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . 0.481 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 0.3 OUTLIER -61.09 -46.55 90.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.842 0.353 . . . . 0.0 110.791 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.8 -31.0 68.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.061 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -82.41 0.5 41.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.414 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.11 -42.64 8.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 110.945 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.4 t -66.97 136.21 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.216 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -112.6 -178.45 3.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -138.68 160.92 38.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.854 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -126.96 43.34 1.35 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.481 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 136.77 -28.45 2.85 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -76.95 96.36 4.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.881 0.372 . . . . 0.0 110.905 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.21 -30.06 69.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.982 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -42.93 89.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.962 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 31.2 t -62.78 -35.63 71.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.031 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -65.54 -43.81 88.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.12 -32.88 72.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.144 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -68.61 -45.17 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.417 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 11.1 ptt85 -72.63 -44.53 61.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.127 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -63.01 -34.61 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.836 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.12 -39.71 65.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.79 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -71.01 -45.57 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.1 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 46.9 t -62.86 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.959 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 11.8 t -60.9 -35.55 76.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.68 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.55 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.402 HG12 ' CG2' ' A' ' 390' ' ' VAL . 1.1 mt -65.52 -31.24 52.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -43.95 97.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.127 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.41 86.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.608 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 43.9 mt -67.43 -36.39 76.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.842 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.3 tt -57.35 -47.48 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.888 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -41.35 98.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.804 0.335 . . . . 0.0 110.125 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -30.13 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -38.42 85.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.378 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.37 -29.89 62.01 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -89.7 -20.08 24.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.402 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -20.29 36.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.006 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.43 -81.55 0.45 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.469 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.955 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.74 -28.82 38.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.471 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -55.78 -33.11 64.06 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.973 -179.055 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -37.99 85.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.211 0.529 . . . . 0.0 110.617 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . 0.413 HG21 HD13 ' A' ' 383' ' ' ILE . 39.4 mm -60.54 -34.42 58.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.577 178.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.78 -44.39 45.84 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.608 178.62 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -56.42 -42.55 78.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.836 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 38.4 t -70.85 -36.65 65.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.914 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -36.05 80.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.157 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -35.1 78.69 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -34.61 73.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.81 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 25.7 t -74.85 -35.82 37.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.312 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.37 -41.01 83.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.581 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.28 -41.81 76.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.05 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 -37.94 88.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.328 179.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -60.9 -41.15 95.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -39.79 88.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.37 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -68.76 -39.17 80.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.524 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 35.2 t -60.71 -34.46 58.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.605 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -59.02 -40.24 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.989 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.8 tt0 -86.7 -68.23 0.76 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.823 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.466 ' CG ' HD21 ' A' ' 412' ' ' LEU . 4.7 t80 52.42 -80.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.454 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . 0.496 ' N ' ' O ' ' A' ' 399' ' ' GLU . 17.3 t 74.32 29.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.32 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -101.86 -151.38 24.17 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.654 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.641 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.4 OUTLIER -133.46 171.13 14.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.559 0.219 . . . . 0.0 110.732 -179.853 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.473 ' HA ' ' CD1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -91.98 -8.89 44.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.072 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.81 -14.58 11.34 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.462 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 33.8 t70 -63.62 163.05 11.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.913 0.387 . . . . 0.0 111.405 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.729 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.2 OUTLIER -71.52 -38.09 71.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.349 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.69 -28.94 70.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.622 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.641 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 58.4 t80 -58.26 -45.51 87.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.051 -179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.729 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.64 -30.75 64.57 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 118.92 -1.112 . . . . 0.0 108.658 178.165 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 8.6 tp -64.73 -39.54 93.81 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.135 177.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.466 HD21 ' CG ' ' A' ' 400' ' ' PHE . 7.0 tp -60.48 -46.96 88.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -70.35 -32.2 69.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.9 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.6 -43.25 97.46 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.955 -179.249 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -69.44 -34.9 75.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.279 0.561 . . . . 0.0 110.1 179.143 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -60.42 -40.81 92.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.04 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.8 m -71.71 -32.46 67.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.006 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -47.11 84.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.539 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.58 -43.03 98.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.121 0.486 . . . . 0.0 109.703 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 2.8 tp -62.06 -43.59 98.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.14 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.78 -31.85 72.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.95 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -71.06 -37.14 72.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.79 -31.02 70.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.925 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.16 -8.17 55.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.54 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.8 t -53.44 -30.13 38.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.802 0.334 . . . . 0.0 111.169 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 12.1 m -70.79 131.18 34.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.103 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -85.58 -30.27 23.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.959 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 16.6 m 61.69 157.62 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.831 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -143.73 60.6 0.52 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.575 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 70.39 28.99 70.47 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.462 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -106.43 117.7 34.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.869 0.366 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.33 -31.44 70.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.85 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.0 t -60.31 -44.8 95.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.842 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 26.5 t -75.44 -40.88 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -61.66 -40.99 96.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -34.82 75.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.03 77.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.202 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -71.15 -41.12 70.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.933 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 13.4 ttpt -62.2 -31.53 72.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.762 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -72.24 -37.6 69.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.731 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -66.64 -45.58 78.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.096 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.544 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 20.1 t -71.73 -30.74 39.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 46.8 t -70.71 -46.72 62.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.977 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.11 -44.72 75.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.028 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.544 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.7 pp -63.35 -31.12 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.462 . . . . 0.0 110.771 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.41 -45.76 89.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.271 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.89 -34.19 74.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.536 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 17.1 mt -74.75 -36.48 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.723 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -53.87 53.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.861 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -61.46 -44.08 97.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.823 0.344 . . . . 0.0 110.342 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -29.75 65.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.416 ' CD1' HD22 ' A' ' 412' ' ' LEU . 0.5 OUTLIER -71.88 -40.04 69.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.803 179.479 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 454' ' ' LYS . 0.0 OUTLIER -64.28 -29.84 70.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.786 0.327 . . . . 0.0 110.841 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . 0.436 ' N ' ' HG3' ' A' ' 453' ' ' GLU . 0.3 OUTLIER -91.6 -13.96 31.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.301 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -82.51 -25.7 33.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.976 0.417 . . . . 0.0 110.465 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -72.66 -64.05 2.7 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.263 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.163 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 379' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 382' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.162 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 1.1 mm -58.74 -29.55 40.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.43 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.57 -33.22 65.95 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.631 -179.344 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 383' ' ' ILE . 0.1 OUTLIER -68.35 -37.63 80.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.077 0.465 . . . . 0.0 110.732 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . 0.518 ' N ' ' HG3' ' A' ' 382' ' ' LYS . 16.2 mt -60.97 -34.06 58.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.482 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.439 ' N ' HD12 ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.97 -44.64 44.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.225 178.526 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -56.49 -47.57 78.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.334 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.2 p -66.46 -37.38 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.189 179.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.57 -34.24 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.142 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 12.1 mt-10 -62.74 -34.83 78.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.57 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -70.27 -34.7 73.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.451 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.87 -46.35 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.353 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 394' ' ' GLU . 14.5 pt20 -58.46 -37.49 75.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.696 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . 0.408 ' O ' ' CG ' ' A' ' 395' ' ' GLN . 19.1 t80 -72.34 -35.1 68.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.205 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.35 -37.84 74.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.728 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 395' ' ' GLN . 0.0 OUTLIER -64.87 -38.88 92.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . 0.431 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 12.0 pt20 -69.77 -31.65 69.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.849 0.357 . . . . 0.0 110.467 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -68.73 -39.37 80.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.653 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 42.6 t -60.74 -47.29 93.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.593 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -56.69 -38.69 72.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.462 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -74.28 -58.09 3.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.38 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.567 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 0.1 OUTLIER -56.86 125.15 21.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.367 0.603 . . . . 0.0 110.456 179.729 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . 0.453 ' O ' ' O ' ' A' ' 402' ' ' GLY . 13.7 p -116.53 43.9 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.512 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.567 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.8 -164.3 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.841 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.83 143.79 48.57 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.789 0.328 . . . . 0.0 111.632 -179.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.486 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 7.9 mttt -61.53 -21.13 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.941 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 23.7 m -94.22 8.67 40.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.85 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.409 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t70 -115.07 161.78 17.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.976 0.417 . . . . 0.0 111.027 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.721 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.59 -30.0 65.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.3 179.438 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.81 -29.41 70.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.1 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.486 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 6.1 t80 -73.72 -46.13 47.89 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.296 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.721 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.3 p-90 -73.08 -29.01 62.64 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 118.853 -1.139 . . . . 0.0 108.78 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.604 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.6 tp -67.35 -39.81 85.77 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.886 177.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.469 HD23 ' CD1' ' A' ' 400' ' ' PHE . 2.6 tp -59.67 -46.91 87.63 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 1.6 tt0 -69.85 -31.68 69.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.421 177.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.604 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 2.4 mm-40 -63.48 -38.67 92.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.271 -179.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.52 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 1.9 mmt -69.72 -44.64 69.89 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.749 0.309 . . . . 0.0 111.004 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 413' ' ' GLU . 4.4 pp -69.0 -37.17 78.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.578 -179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 417' ' ' THR . . . . . 0.415 ' N ' ' CD1' ' A' ' 416' ' ' LEU . 1.0 OUTLIER -68.38 -43.75 76.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.733 0.302 . . . . 0.0 111.152 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -57.98 -47.22 83.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.382 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -65.9 -34.94 79.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.415 ' HB2' ' CD1' ' A' ' 445' ' ' ILE . 0.2 OUTLIER -67.05 -39.05 86.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.1 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.32 -31.8 69.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.918 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.01 -44.42 76.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.921 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.01 -35.86 77.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.878 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -79.35 -20.89 46.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 16.7 t -54.02 -30.91 49.53 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.89 0.376 . . . . 0.0 111.036 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.7 t -79.65 116.08 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.961 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.23 -34.01 61.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.32 131.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.127 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.98 -89.2 1.79 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.372 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -107.86 64.63 0.26 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.335 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -139.56 87.5 2.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.851 0.358 . . . . 0.0 110.899 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -40.95 95.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.975 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 2.9 t -59.11 -43.28 91.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.011 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 34.3 t -69.11 -35.53 68.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -44.47 78.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -69.31 -33.0 72.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.998 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.51 -44.73 67.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.433 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -69.52 -40.66 76.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.214 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -44.9 82.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.891 0.377 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -69.82 -39.44 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.524 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.136 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.449 ' O ' ' CG ' ' A' ' 446' ' ' GLN . 41.0 t -62.94 -45.6 98.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.072 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . 0.608 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.6 m -60.38 -30.35 69.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.725 0.297 . . . . 0.0 110.213 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . 0.43 ' O ' HG13 ' A' ' 448' ' ' ILE . 37.9 tttp -63.94 -43.14 96.73 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.415 ' CD1' ' HB2' ' A' ' 420' ' ' LEU . 0.9 OUTLIER -73.62 -34.85 42.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.935 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . 0.608 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.3 OUTLIER -60.7 -48.02 83.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.709 178.871 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -55.85 -42.7 76.21 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.72 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 444' ' ' LYS . 11.3 mt -64.52 -36.33 77.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.837 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.13 -44.66 83.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.894 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 -44.07 64.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 0.0 110.193 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 31.1 mtmm -57.86 -29.94 65.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.17 0.509 . . . . 0.0 109.666 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.413 ' CD1' HD21 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -73.73 -36.71 65.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.441 179.304 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -29.98 67.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -93.68 -19.34 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm -82.55 -20.81 35.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.735 0.303 . . . . 0.0 110.919 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.402 ' HA3' ' CD2' ' A' ' 409' ' ' TYR . . . -82.12 -101.37 0.43 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.43 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.278 -0.868 . . . . 0.0 110.945 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.519 -0.236 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 31.2 mm -58.65 -29.75 40.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.452 ' HA ' HG12 ' A' ' 384' ' ' ILE . 11.5 mttt -56.77 -33.17 66.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.047 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 4.2 pttm -68.27 -38.0 81.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.164 0.507 . . . . 0.0 110.517 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 43.6 mm -60.5 -33.37 54.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.521 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.452 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.84 -44.73 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.209 178.495 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -57.0 -49.38 75.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.48 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 40.9 t -64.15 -36.13 75.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.41 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.46 -34.54 77.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.375 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . 0.432 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.0 tt0 -62.77 -35.0 78.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.622 179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -70.41 -34.57 72.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.728 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 25.8 t -65.35 -46.91 89.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 4.6 pt20 -63.15 -37.76 88.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.84 0.352 . . . . 0.0 110.708 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.22 -36.87 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.09 179.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 3.5 mt -65.91 -37.77 86.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.296 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -58.7 -44.53 90.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.561 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -41.35 89.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.461 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -69.2 -39.92 78.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.013 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.62 -30.66 47.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.803 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -66.83 -33.13 74.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.415 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' A' ' 400' ' ' PHE . 16.5 tt0 -89.43 -55.41 3.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.533 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.549 ' CE2' ' HA3' ' A' ' 402' ' ' GLY . 13.8 t80 -20.35 120.27 0.03 OUTLIER 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 11.6 p -100.5 29.43 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.625 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.549 ' HA3' ' CE2' ' A' ' 400' ' ' PHE . . . -41.9 162.8 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.527 -0.761 . . . . 0.0 113.777 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 1.4 mppt? -133.56 143.67 48.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.151 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -17.46 53.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.703 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.4 m -108.4 -15.54 14.43 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.503 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 14.2 t70 -76.24 135.25 39.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.925 0.393 . . . . 0.0 110.743 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.726 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 mptp? -61.13 -30.82 70.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.214 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 412' ' ' LEU . . . -65.41 -29.13 69.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.409 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 0.2 OUTLIER -68.95 -45.59 70.34 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.539 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.726 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 15.7 p-90 -72.86 -30.13 63.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.069 -1.053 . . . . 0.0 108.886 178.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.592 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 25.9 tp -69.76 -38.56 76.81 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.327 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.501 ' CD2' ' CD2' ' A' ' 400' ' ' PHE . 0.4 OUTLIER -62.09 -47.26 85.42 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.147 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 -32.28 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.302 177.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.592 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.77 -36.42 83.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.532 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 10.9 ttt -69.57 -41.05 76.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.004 0.431 . . . . 0.0 110.171 179.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 3.9 mt -62.43 -46.92 86.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.639 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 7.6 m -65.8 -30.44 71.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.767 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -47.31 86.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.159 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.584 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.49 -38.85 81.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.472 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.3 mp -66.56 -31.98 73.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.668 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -45.07 86.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.748 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 5.5 mt -57.69 -32.57 67.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.007 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -79.88 -31.84 40.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 10.0 t -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.5 t -80.56 119.64 30.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -70.39 131.66 44.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.933 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 19.0 p -108.48 -36.91 6.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.888 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 90.39 -91.96 1.73 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.488 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -152.54 47.78 0.55 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.5 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.01 115.64 28.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 0.0 110.797 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -42.97 80.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 25.6 t -64.2 -44.86 90.66 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.923 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 37.8 t -69.55 -40.76 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -44.35 91.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.926 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -38.35 78.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -66.64 -45.13 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.273 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -68.11 -39.37 82.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.956 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -66.25 -34.44 78.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -71.39 -39.34 71.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.88 97.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.158 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.85 -39.64 85.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.996 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -36.63 79.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.492 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -34.69 78.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.572 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . . . . . . . . . 3.1 mm -66.78 -31.19 52.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.14 0.495 . . . . 0.0 110.751 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -45.99 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.663 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.47 -38.46 87.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.039 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 16.3 mt -74.83 -36.57 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.51 -43.56 84.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.938 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.77 62.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.629 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -57.84 -32.67 67.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 109.808 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.64 -36.6 51.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.402 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.17 -30.0 61.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.553 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -91.95 -12.4 33.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.176 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -82.16 -26.4 33.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.125 0.488 . . . . 0.0 110.828 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -82.97 -96.32 0.55 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.375 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.008 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 81.3 p . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 120.694 0.283 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 28.9 mm -58.6 -29.65 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.439 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -33.2 66.35 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.849 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -67.25 -38.02 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.091 0.472 . . . . 0.0 110.836 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 34.3 mt -60.52 -34.54 58.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.376 178.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.439 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.94 -44.67 44.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.318 178.444 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -57.02 -49.35 76.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.411 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.52 -37.78 80.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.483 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.499 ' O ' HG11 ' A' ' 390' ' ' VAL . 4.3 tt -67.57 -32.96 74.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.82 -35.21 79.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.48 66.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.147 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . 0.499 HG11 ' O ' ' A' ' 387' ' ' LEU . 2.4 p -63.5 -39.09 84.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.479 -179.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.16 -34.52 77.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.901 0.381 . . . . 0.0 110.627 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.99 -43.46 95.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.579 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -37.91 82.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.596 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -58.79 -44.05 90.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.485 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.62 -31.65 72.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.509 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -68.42 -44.17 75.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . 0.402 ' CG1' ' HG ' ' A' ' 452' ' ' LEU . 19.7 t -60.68 -38.05 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.821 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -59.49 -32.58 70.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.522 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -78.63 -57.35 3.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.555 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.541 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 0.3 OUTLIER -60.34 127.7 33.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.288 0.566 . . . . 0.0 110.53 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 22.1 t -123.11 39.86 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.401 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.541 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -53.76 -166.13 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.678 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.485 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.96 149.19 51.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 0.0 111.853 -179.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.479 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 2.0 mmmt -58.78 -25.09 62.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.081 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 70.9 p -85.94 3.7 40.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.448 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.485 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 26.4 t70 -111.96 156.68 21.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.111 0.482 . . . . 0.0 111.432 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.738 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.4 mttp -69.31 -29.97 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.039 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.87 -29.42 70.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.328 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.479 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 33.1 t80 -69.2 -45.53 69.65 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.969 -179.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.738 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.3 OUTLIER -72.63 -32.66 66.07 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 118.628 -1.229 . . . . 0.0 108.539 178.162 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 17.8 tp -63.57 -38.35 90.79 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.477 ' HG ' ' CE1' ' A' ' 400' ' ' PHE . 0.4 OUTLIER -59.71 -47.15 86.8 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.465 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -70.38 -31.78 69.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.893 177.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.32 -40.17 96.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.222 -178.581 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.464 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.62 -44.2 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.222 0.534 . . . . 0.0 109.909 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 7.0 tp -66.36 -41.0 90.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.78 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 417' ' ' THR . . . . . 0.417 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 94.9 m -62.69 -30.36 71.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -71.01 -44.65 65.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.596 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -64.23 -44.64 91.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.625 0.25 . . . . 0.0 111.41 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.417 ' CD2' ' HA ' ' A' ' 417' ' ' THR . 1.4 pp -66.27 -35.34 80.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.893 0.378 . . . . 0.0 110.511 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . 0.407 ' CD1' ' CD1' ' A' ' 420' ' ' LEU . 3.9 mp -70.31 -31.87 69.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.446 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.53 -46.28 90.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 1.8 mp -66.12 -31.01 71.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.719 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -58.37 -26.5 63.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.01 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.05 38.35 1.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.863 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 14.2 p -91.19 130.02 41.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.64 -70.13 0.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.984 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 27.5 m 67.25 -69.5 0.13 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.028 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 98.37 -60.58 0.92 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 177.76 38.39 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.421 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -93.43 120.08 33.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.818 0.342 . . . . 0.0 110.926 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -31.07 69.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 21.5 t -65.42 -42.03 92.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.932 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 39.9 t -68.29 -37.45 77.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.92 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.755 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.16 -34.37 74.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.924 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.04 -45.16 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -44.24 83.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.972 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -60.46 -39.45 87.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -69.76 -31.71 69.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.727 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . 0.427 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -69.4 -45.66 68.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.11 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.496 ' HA ' ' CD1' ' A' ' 445' ' ' ILE . 25.6 t -64.25 -34.3 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.866 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -45.09 95.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.215 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -37.2 86.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.083 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.496 ' CD1' ' HA ' ' A' ' 442' ' ' VAL . 24.2 mt -64.36 -32.73 58.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.704 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.58 -47.59 83.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.011 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.84 -42.45 93.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.17 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 34.2 mt -63.6 -36.56 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.803 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.3 tp -57.58 -47.59 81.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.817 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -34.53 68.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -57.87 -33.2 68.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.987 0.422 . . . . 0.0 110.313 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.402 ' HG ' ' CG1' ' A' ' 397' ' ' VAL . 1.8 mt -77.66 -36.79 51.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.434 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.92 -29.87 63.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.791 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -22.2 17.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.059 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -82.43 -19.88 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.958 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -86.32 -103.51 0.76 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.418 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.963 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.159 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 6.0 mt -58.85 -29.91 41.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.431 ' HA ' HG12 ' A' ' 384' ' ' ILE . 1.3 mttt -56.96 -33.15 66.76 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.868 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -66.69 -38.04 85.98 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 110.928 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 33.7 mm -60.52 -35.59 64.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.293 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.431 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.91 -44.55 44.9 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.387 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.516 178.383 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -49.25 75.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.782 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.77 -33.65 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.672 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.25 -37.84 84.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.558 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . 0.405 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 10.3 mt-10 -62.6 -34.64 77.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.744 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -67.58 -34.66 77.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.477 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 32.4 t -66.21 -46.69 86.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.2 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 11.7 pt20 -62.89 -40.47 97.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.863 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . 0.403 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 0.2 OUTLIER -68.92 -44.18 73.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.855 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -58.57 -40.26 82.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.764 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -59.8 -46.61 88.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.018 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.5 -36.14 75.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.14 -41.73 76.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.388 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 19.7 t -60.57 -45.75 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.328 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -24.12 31.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.006 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -95.77 -55.72 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.559 ' CZ ' ' CA ' ' A' ' 402' ' ' GLY . 0.0 OUTLIER -51.85 -27.08 11.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 -179.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 21.1 t 66.4 -44.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.627 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.559 ' CA ' ' CZ ' ' A' ' 400' ' ' PHE . . . 68.22 158.22 1.18 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.013 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.534 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.3 143.6 49.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.601 179.372 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -67.68 -15.05 63.45 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.6 t -115.54 8.96 15.28 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.441 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 35.9 t0 -100.67 136.6 40.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.833 0.349 . . . . 0.0 110.8 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.748 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.31 -31.8 71.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.887 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.97 -29.03 70.5 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.712 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.534 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -65.9 -45.31 82.42 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.748 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.9 p-90 -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.177 178.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.573 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 18.0 tp -69.65 -38.89 77.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.642 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.51 ' CD2' ' CE1' ' A' ' 400' ' ' PHE . 0.3 OUTLIER -62.55 -46.99 85.86 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.141 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.472 ' HA ' ' CD2' ' A' ' 416' ' ' LEU . 21.5 mt-10 -70.32 -32.42 70.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.429 177.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.573 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 4.5 mt-10 -66.38 -44.6 82.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.9 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.421 ' HG2' ' O ' ' A' ' 412' ' ' LEU . 8.3 ptm -65.71 -42.43 91.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.679 0.276 . . . . 0.0 111.312 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.472 ' CD2' ' HA ' ' A' ' 413' ' ' GLU . 3.1 pp -67.24 -36.69 82.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.907 0.384 . . . . 0.0 110.663 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 417' ' ' THR . . . . . 0.427 ' N ' HD13 ' A' ' 416' ' ' LEU . 0.7 OUTLIER -62.79 -33.89 76.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.737 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . 0.475 ' O ' HD13 ' A' ' 421' ' ' LEU . 7.8 mttt -73.06 -34.15 66.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.052 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.469 ' HG2' ' HA ' ' A' ' 416' ' ' LEU . 7.7 pt-20 -72.83 -38.31 67.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 4.3 pp -70.5 -43.71 69.13 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . 0.484 ' CD1' ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.56 -31.45 68.48 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.163 -179.288 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . 0.484 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 0.1 OUTLIER -64.35 -46.72 82.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.82 0.343 . . . . 0.0 111.47 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 1.9 pp -68.02 -30.94 70.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.167 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 -3.83 41.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.525 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.2 m -86.16 -5.03 59.28 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.553 0.216 . . . . 0.0 111.56 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.68 137.82 24.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.864 0.364 . . . . 0.0 111.066 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -73.06 156.49 38.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.887 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 69.1 p -137.24 110.68 7.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.907 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -82.43 -37.0 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.439 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 172.81 49.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.486 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -126.73 111.33 14.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.772 0.32 . . . . 0.0 110.93 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -67.1 -32.45 73.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.929 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -40.94 96.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 25.8 t -71.57 -39.82 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.093 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -44.67 90.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.745 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.53 -43.17 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.161 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.18 91.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.754 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 10.1 ptt85 -70.31 -40.42 74.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.68 0.276 . . . . 0.0 111.042 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.84 -32.91 74.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.07 -41.98 63.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.03 -45.57 92.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.21 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 46.2 t -69.55 -38.83 77.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.712 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.36 -39.21 93.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.873 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -63.19 -40.72 98.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.515 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.421 ' CD1' ' HB3' ' A' ' 420' ' ' LEU . 0.5 OUTLIER -63.81 -31.18 52.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.798 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -41.04 97.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.879 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.62 -37.27 83.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.237 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 31.7 mt -67.3 -36.4 76.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.58 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.8 mt -57.29 -46.99 82.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.751 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.5 -46.13 89.83 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -58.43 -30.02 66.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.241 0.543 . . . . 0.0 109.614 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.29 -36.77 53.89 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.335 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -61.73 -31.8 71.99 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.38 -19.35 20.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.971 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.9 mtmt -82.45 -23.37 34.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.353 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 402' ' ' GLY . . . -72.32 -93.13 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.6 mp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.217 179.796 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 63.7 m . . . . . 0 CA--C 1.52 -0.175 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 34.1 mm -58.68 -30.11 41.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 7.5 mmtt -59.0 -33.32 70.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.884 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 7.5 mtpp -68.19 -38.12 81.66 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.17 0.509 . . . . 0.0 110.879 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 37.9 mm -60.45 -34.55 58.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.411 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.437 HD11 ' N ' ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.95 -44.72 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.414 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -47.19 80.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.009 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 47.5 t -70.39 -42.85 78.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.124 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.08 -38.88 92.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.771 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -62.75 -34.71 77.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -40.9 96.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.389 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . 0.427 ' CG1' ' CD1' ' A' ' 445' ' ' ILE . 56.2 t -61.42 -37.94 78.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.591 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -41.13 93.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.71 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -72.53 -44.54 62.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.642 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -59.01 -42.48 90.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.755 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.28 -44.33 95.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -35.86 77.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.015 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -45.02 71.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . 0.41 ' CG2' ' CG2' ' A' ' 448' ' ' ILE . 17.1 t -60.58 -39.6 81.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.975 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -58.52 -38.91 78.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.012 0.434 . . . . 0.0 110.333 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -80.67 -54.45 5.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.349 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.6 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 42.8 t80 -21.4 116.86 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.401 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 25.5 m -111.21 27.03 2.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.192 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.6 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -54.72 -172.82 0.08 OUTLIER Glycine 0 N--CA 1.442 -0.962 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.326 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.515 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.89 143.86 48.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.781 -0.71 . . . . 0.0 111.236 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.25 -27.38 14.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.525 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.32 11.32 29.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.599 -179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -93.17 142.67 27.04 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.768 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.19 -30.29 70.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.983 0.42 . . . . 0.0 110.665 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -68.0 -29.16 68.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.836 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.515 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -66.52 -45.29 79.99 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.768 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 9.3 p-90 -72.67 -30.58 64.39 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 119.045 -1.062 . . . . 0.0 109.13 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.8 tp -69.79 -38.49 76.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.303 177.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.469 ' HG ' ' CD2' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -63.03 -47.07 84.63 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.092 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.447 ' HA ' ' CD2' ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.33 -32.04 69.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.372 177.86 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.586 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.87 -41.46 97.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.49 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 18.5 ptp -69.58 -44.54 70.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.637 0.256 . . . . 0.0 111.448 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.447 ' CD2' ' HA ' ' A' ' 413' ' ' GLU . 4.3 pp -66.48 -37.1 84.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.884 0.373 . . . . 0.0 110.231 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 417' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 420' ' ' LEU . 99.2 m -62.85 -30.39 71.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.208 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . 0.471 ' O ' HD11 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -72.24 -32.65 66.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.913 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -72.72 -46.38 53.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.307 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.409 ' HB3' ' CB ' ' A' ' 445' ' ' ILE . 2.5 pp -62.96 -46.21 88.79 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.21 -178.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . 0.493 ' CD1' ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -68.2 -31.44 70.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 110.817 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . 0.493 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 1.3 tm-20 -58.33 -46.44 86.19 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.842 0.353 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -33.56 73.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.75 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -68.06 -28.3 67.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.962 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.5 p -96.57 38.53 1.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 10.2 p -86.14 137.78 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.85 110.03 16.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.04 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.3 t -156.02 121.7 4.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.16 -49.25 2.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.476 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -136.32 62.96 0.59 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.498 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -139.27 84.94 2.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.823 0.344 . . . . 0.0 110.922 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.56 -31.89 69.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -42.32 99.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 30.8 t -66.33 -45.6 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.068 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.78 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -68.14 -47.21 68.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.884 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.1 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.008 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -67.61 -36.64 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -66.94 -44.77 79.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.722 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.91 -34.7 76.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -70.32 -45.02 67.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.041 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 24.9 t -62.92 -45.91 97.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.99 -34.11 74.29 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.526 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.06 -36.4 83.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.944 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.427 ' CD1' ' CG1' ' A' ' 390' ' ' VAL . 1.7 mm -68.42 -31.31 50.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.292 179.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.63 -47.69 83.52 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.762 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.68 -35.36 80.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.425 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . 0.41 ' CG2' ' CG2' ' A' ' 397' ' ' VAL . 10.3 mt -74.58 -36.44 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.772 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.4 -55.4 35.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.687 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.07 -37.92 81.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.24 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 7.0 mtmm -57.86 -31.6 66.84 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.403 HD21 ' CG ' ' A' ' 412' ' ' LEU . 1.5 tm? -68.38 -38.95 81.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.393 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -60.81 -30.0 69.8 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.23 -15.74 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.131 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -22.65 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 110.837 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.68 -100.61 0.71 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.993 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.519 -0.231 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 32.8 mm -58.71 -29.84 40.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.419 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -37.28 70.82 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.16 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -64.59 -38.19 90.16 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.028 0.442 . . . . 0.0 111.185 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 16.6 mt -61.19 -35.24 64.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.328 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.419 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -75.05 -44.78 43.83 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.332 178.463 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -56.69 -49.41 75.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.918 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.69 -42.93 93.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.859 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.483 ' O ' HG11 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.57 -32.65 73.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.784 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -35.18 79.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -44.43 68.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.62 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . 0.483 HG11 ' O ' ' A' ' 387' ' ' LEU . 1.6 p -66.45 -35.91 76.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.634 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.16 -40.66 90.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.533 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -35.07 68.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.83 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.87 -43.57 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.121 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 395' ' ' GLN . 0.1 OUTLIER -68.07 -33.28 74.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.777 0.323 . . . . 0.0 110.788 179.933 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . 0.43 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 1.8 tt0 -66.44 -35.59 80.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -69.1 -37.56 78.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.812 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 16.2 t -60.61 -40.49 84.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -55.86 -32.98 64.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.053 0.454 . . . . 0.0 110.301 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.43 ' O ' ' C ' ' A' ' 400' ' ' PHE . 30.6 tt0 -88.91 -54.34 4.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.296 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.623 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 35.1 t80 -20.84 124.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.131 -0.94 . . . . 0.0 113.299 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.0 p -120.9 24.77 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.392 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.623 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -59.61 -171.11 0.45 Allowed Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.949 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.83 143.45 48.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.288 -0.456 . . . . 0.0 111.354 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.448 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -53.1 -26.96 18.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.225 179.41 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.88 14.6 30.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.19 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -106.64 147.81 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.886 0.374 . . . . 0.0 110.957 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.776 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 2.3 ttpt -61.17 -30.33 70.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.691 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -66.09 -29.24 69.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.144 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 52.5 t80 -70.88 -45.94 63.49 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.776 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -72.97 -30.56 63.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 118.612 -1.235 . . . . 0.0 108.568 177.716 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 39.1 tp -66.41 -40.03 89.34 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.016 177.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.466 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.79 -47.04 87.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.613 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.45 ' HA ' ' CD2' ' A' ' 416' ' ' LEU . 29.8 mt-10 -70.32 -31.99 69.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.779 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.602 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.52 -41.41 98.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.712 -178.902 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.44 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 6.5 mmm -69.53 -44.67 70.49 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.906 0.384 . . . . 0.0 110.936 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.533 ' O ' ' HG3' ' A' ' 419' ' ' GLU . 4.4 pp -68.59 -36.83 79.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.158 179.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 417' ' ' THR . . . . . 0.402 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 95.4 m -72.03 -30.32 65.07 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.595 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -62.58 -47.45 83.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.572 -179.651 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' A' ' 416' ' ' LEU . 1.2 pp20? -65.3 -46.44 80.35 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.402 ' CD2' ' HA ' ' A' ' 417' ' ' THR . 0.3 OUTLIER -60.55 -34.51 74.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.102 0.477 . . . . 0.0 109.877 179.303 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.35 -31.77 69.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.179 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.23 -46.41 85.95 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.376 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 1.3 mt -70.29 -45.74 65.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.614 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 40.88 37.36 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.745 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.0 t 59.75 55.09 4.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 3.6 m -66.38 117.65 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.056 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.32 149.91 27.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.052 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 72.4 p -110.86 -27.14 8.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.994 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 106.81 -27.19 17.14 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.354 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 168.42 41.27 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.27 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.46 96.86 5.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 0.0 110.958 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.86 -31.79 72.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.815 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.28 -43.85 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.835 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 38.8 t -68.08 -37.99 79.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -40.76 87.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -66.14 -38.3 87.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.787 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.68 -38.73 73.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.027 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -62.13 -44.43 96.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.81 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -66.48 -37.05 84.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.81 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.47 -39.6 88.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.917 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.47 69.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.078 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 31.8 t -62.88 -44.98 99.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.84 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.5 m -60.85 -34.91 75.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.236 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -63.16 -34.62 78.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . . . . . . . . . 3.4 mm -66.35 -36.63 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-O 121.249 0.547 . . . . 0.0 110.531 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.92 -47.72 84.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.187 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.79 87.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.082 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 15.7 mt -73.52 -36.54 48.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.84 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.39 -46.67 83.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.905 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -38.33 70.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.524 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.85 -30.07 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.118 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.1 mt -77.58 -36.62 51.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.594 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -29.96 60.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.857 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -96.6 -12.35 24.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.332 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.53 -24.02 34.29 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.746 0.308 . . . . 0.0 110.846 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.428 ' HA2' ' HA ' ' A' ' 403' ' ' LYS . . . -92.42 -76.19 1.32 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.632 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 93.6 p . . . . . 0 CA--C 1.519 -0.217 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 27.7 mm -58.76 -29.82 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.426 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.36 -33.25 67.59 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.983 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -68.23 -38.1 81.5 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.174 0.512 . . . . 0.0 110.782 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.5 -34.14 57.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.433 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.43 HD11 ' N ' ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.94 -44.8 44.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.469 178.649 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -58.57 -49.4 77.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.084 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 46.8 t -68.31 -46.17 81.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.156 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.846 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.77 -34.88 78.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.21 0.529 . . . . 0.0 109.834 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -38.96 81.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.506 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 24.3 t -67.3 -36.0 75.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.741 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -41.11 96.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.664 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.82 -45.6 67.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.544 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -38.0 83.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.59 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -60.68 -42.03 96.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.698 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -58.06 -44.82 87.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.827 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.25 -45.25 70.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.775 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 58.2 t -60.64 -32.55 51.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.706 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.12 -34.72 76.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.044 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' O ' ' A' ' 400' ' ' PHE . 6.6 tt0 -91.43 -68.62 0.78 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.17 179.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.567 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 4.7 t80 54.55 157.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.591 0.71 . . . . 0.0 111.888 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 5.0 m -141.12 20.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.853 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.567 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -104.08 -170.46 25.12 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.889 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.421 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -134.14 143.93 48.24 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.58 -0.31 . . . . 0.0 111.68 -179.545 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.485 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 3.2 tttt -51.13 -28.77 11.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.138 179.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.74 14.34 32.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.391 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.19 164.97 11.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.799 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.41 -30.8 66.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.14 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.02 -29.14 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.027 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.485 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 18.5 t80 -69.38 -45.43 69.34 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.799 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.75 64.34 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.903 178.18 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.55 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -68.1 -39.33 82.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.454 177.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.471 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 10.0 tp -61.28 -46.85 88.64 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.33 -31.9 69.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.657 177.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.571 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 0.4 OUTLIER -63.38 -44.6 94.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.959 -179.166 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 6.3 ptp -66.29 -36.9 84.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.071 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 8.5 tp -68.69 -41.91 78.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.493 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -32.83 73.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.843 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.55 -47.19 76.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -66.29 -40.3 89.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.902 0.382 . . . . 0.0 110.704 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 1.0 OUTLIER -66.46 -33.58 76.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.094 0.473 . . . . 0.0 110.381 179.561 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.64 -31.79 68.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.102 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -46.52 73.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.32 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 420' ' ' LEU . 3.3 pp -65.24 -31.18 72.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.339 . . . . 0.0 110.939 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -70.09 -26.82 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 1.8 t -57.96 -25.92 61.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.159 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 23.7 t -66.63 134.86 29.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.89 0.376 . . . . 0.0 111.098 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -101.82 -177.79 3.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -151.13 138.38 19.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.86 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.87 28.27 16.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.547 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 97.16 43.68 2.97 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.467 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -116.43 129.05 56.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.862 0.363 . . . . 0.0 110.831 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -67.19 -37.45 83.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.34 -43.93 95.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.817 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 29.4 t -60.64 -46.1 96.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.08 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -34.3 74.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.782 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -64.71 -34.31 78.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.829 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.56 -43.64 69.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.155 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 438' ' ' ARG . 1.3 mmp_? -61.89 -44.53 96.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.924 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.49 -43.09 99.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.012 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.45 -45.0 95.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.074 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -70.88 -45.58 64.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.319 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.548 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 38.5 t -69.37 -30.7 46.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.025 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 54.1 t -70.66 -43.09 69.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.78 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.83 -44.58 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.062 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.548 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.8 pp -63.27 -31.12 51.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.765 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.48 -46.57 82.48 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.631 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -58.97 -36.79 75.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 24.4 mt -66.78 -36.53 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.9 tt -57.64 -58.71 7.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.813 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.94 -38.05 81.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.415 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.4 mmpp? -57.94 -29.88 65.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.415 ' CD1' HD22 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -71.33 -38.86 71.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.525 179.311 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.68 -29.98 65.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.121 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -20.7 23.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -20.6 36.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.768 0.318 . . . . 0.0 110.981 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.46 -90.33 0.18 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.329 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.216 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.6 -29.58 39.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.404 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.8 OUTLIER -56.94 -33.85 67.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.252 -179.517 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -68.43 -38.11 80.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.127 0.489 . . . . 0.0 110.827 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 40.7 mm -60.52 -33.98 56.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.524 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.94 -44.78 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.584 178.582 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . 0.415 ' CG ' ' N ' ' A' ' 386' ' ' VAL . 0.0 OUTLIER -59.26 -49.47 77.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.511 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . 0.415 ' N ' ' CG ' ' A' ' 385' ' ' HIS . 14.7 p -64.0 -43.5 97.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.59 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.2 tt -60.7 -34.43 74.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.384 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.8 -35.01 78.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.519 178.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 -34.48 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.55 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 22.5 t -61.63 -46.85 95.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.488 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -64.98 -35.51 81.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.836 0.35 . . . . 0.0 110.797 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -40.8 74.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.632 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -41.7 97.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.618 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.21 -38.54 83.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.22 -35.34 80.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.826 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -69.27 -39.9 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 23.5 t -60.71 -44.85 98.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.028 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -55.76 -40.32 72.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 400' ' ' PHE . 15.3 tt0 -78.19 -53.93 6.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.304 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.593 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 35.1 t80 -22.65 123.28 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.09 -0.959 . . . . 0.0 113.145 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 11.6 p -118.33 24.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.444 178.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.593 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -61.09 -169.37 0.58 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.941 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.556 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.7 143.64 48.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.498 . . . . 0.0 111.17 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.16 -27.99 6.7 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.87 11.99 19.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.509 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 29.8 t70 -93.5 154.61 17.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 110.963 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -32.72 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.557 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -63.0 -45.9 90.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.897 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.556 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 11.8 t80 -61.34 -44.53 97.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.919 0.39 . . . . 0.0 110.672 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -59.13 -48.65 80.84 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.558 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.2 tp -65.01 -38.47 91.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' A' ' 408' ' ' ALA . 0.2 OUTLIER -61.04 -47.43 86.43 Favored 'General case' 0 C--N 1.339 0.113 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -70.68 -32.29 69.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.572 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.6 mt-10 -63.7 -39.65 94.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.838 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 1.6 ttt -69.45 -42.01 75.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.959 0.409 . . . . 0.0 110.167 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.04 -40.41 93.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.549 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 417' ' ' THR . . . . . 0.458 ' O ' ' HG ' ' A' ' 420' ' ' LEU . 2.7 m -64.13 -32.97 74.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.446 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . 0.51 ' HA ' HD13 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -73.12 -23.58 60.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.81 -46.64 52.08 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.056 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.472 ' HB3' ' CD1' ' A' ' 445' ' ' ILE . 0.8 OUTLIER -64.79 -50.19 67.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.242 -178.965 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' A' ' 418' ' ' LYS . 0.0 OUTLIER -64.29 -31.38 72.57 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.176 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . 0.491 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 5.3 tp10 -64.25 -38.77 92.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . 0.423 ' CD2' ' CB ' ' A' ' 441' ' ' ALA . 0.4 OUTLIER -73.83 -31.19 63.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.007 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -74.16 -28.15 61.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.966 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 83.1 p -98.69 39.73 1.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 23.8 t -101.07 136.74 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.35 138.8 58.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.9 p -153.94 163.7 39.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.925 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -173.75 98.67 0.13 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.17 49.74 55.7 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.466 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -147.76 87.25 1.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.838 0.351 . . . . 0.0 110.952 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -64.58 -33.88 76.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.928 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 9.5 m -60.54 -44.74 95.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.923 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 32.6 t -66.53 -36.13 76.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.44 -39.15 85.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.861 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -69.1 -32.93 72.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.951 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.82 -45.23 62.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.237 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -62.23 -31.53 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.56 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -67.97 -37.52 81.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . 0.423 ' CB ' ' CD2' ' A' ' 423' ' ' LEU . . . -61.87 -45.66 92.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.865 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.499 ' O ' HG13 ' A' ' 445' ' ' ILE . 57.8 t -66.99 -36.31 76.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 16.0 m -70.9 -46.77 61.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.658 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -44.57 89.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.892 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 442' ' ' VAL . 2.8 pp -63.21 -31.36 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.191 0.52 . . . . 0.0 110.294 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -59.09 -47.73 84.19 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.586 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.13 -37.41 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.335 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 41.9 mt -69.08 -36.36 73.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.594 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.2 tt -57.49 -47.28 82.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.66 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -37.84 88.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.246 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -30.14 65.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.803 178.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.423 HD11 ' CE2' ' A' ' 400' ' ' PHE . 4.8 tp -73.09 -36.69 66.84 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.291 179.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -57.07 -29.92 63.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.477 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm -92.85 -12.45 31.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.29 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -25.48 33.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.925 0.393 . . . . 0.0 110.361 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.41 -70.19 1.31 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.459 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.946 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 29.1 t . . . . . 0 CA--C 1.519 -0.247 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 33.5 mm -58.76 -29.7 40.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.431 ' HA ' HG12 ' A' ' 384' ' ' ILE . 4.0 mtpt -57.03 -33.19 66.95 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.019 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -66.7 -38.05 85.97 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.196 0.522 . . . . 0.0 110.841 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 18.9 mt -60.5 -35.74 65.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.308 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.431 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -75.03 -44.65 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.592 178.53 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -58.08 -49.38 77.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.893 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.23 -46.09 78.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.079 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.16 -36.46 81.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.941 0.4 . . . . 0.0 110.502 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.82 -34.76 77.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.739 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -36.36 74.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.785 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 15.6 t -66.84 -46.75 84.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.063 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -61.79 -37.5 84.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.627 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -72.4 -47.98 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.807 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 4.4 mt -60.73 -39.36 88.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.651 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -61.3 -40.66 94.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.751 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -31.83 73.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.737 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -68.79 -40.37 79.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . 0.445 ' CG1' ' HG ' ' A' ' 452' ' ' LEU . 30.3 t -60.64 -40.13 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.784 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.58 -37.0 70.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.119 0.485 . . . . 0.0 110.371 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -83.57 -54.38 4.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.254 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.614 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 51.2 t80 -27.69 109.18 0.04 OUTLIER 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.023 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 20.4 t -102.36 26.36 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.298 178.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.614 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -56.3 -175.91 0.25 Allowed Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.118 -179.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.496 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.66 48.25 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.819 -0.69 . . . . 0.0 111.511 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.427 ' HG2' ' CZ ' ' A' ' 409' ' ' TYR . 0.9 OUTLIER -53.5 -26.3 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.423 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 7.9 t -94.95 -15.48 23.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.552 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 9.2 t70 -77.44 142.29 39.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.762 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 46.2 mttm -61.71 -30.41 70.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.636 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.07 -29.08 70.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.728 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 24.3 t80 -67.77 -45.46 74.83 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.762 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.2 p-90 -72.73 -29.34 63.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.056 178.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.609 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.1 tp -69.54 -40.39 76.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.158 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.465 ' HG ' ' CD2' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.68 -46.96 87.49 Favored 'General case' 0 C--N 1.339 0.141 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.885 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -70.09 -31.52 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.521 177.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.609 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.6 OUTLIER -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.018 -179.181 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.49 -39.74 77.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.217 0.532 . . . . 0.0 109.896 178.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.401 ' O ' ' HG3' ' A' ' 419' ' ' GLU . 0.1 OUTLIER -60.6 -42.72 97.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.881 179.962 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 3.2 m -65.92 -32.72 74.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.689 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -47.21 84.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.569 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.497 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 0.0 OUTLIER -63.55 -34.55 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 0.4 OUTLIER -68.88 -41.2 78.66 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.916 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.75 -31.87 68.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.328 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 -46.55 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.943 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 420' ' ' LEU . 3.1 pp -58.81 -30.7 67.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.743 0.306 . . . . 0.0 111.261 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -91.75 31.77 1.18 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.371 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.34 -17.58 8.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.446 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.4 m -66.59 137.87 24.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.792 0.33 . . . . 0.0 111.386 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -87.73 86.47 7.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 5.5 p -84.22 131.99 34.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.795 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -93.19 -76.38 1.33 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.532 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -131.61 44.52 1.2 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.415 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -106.99 92.54 4.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.825 0.345 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -67.55 -40.39 84.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.989 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 76.6 p -58.66 -44.88 90.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.852 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.43 -39.89 87.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.981 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -58.88 -42.8 90.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -36.68 83.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.639 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.56 -40.61 95.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -44.3 81.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.9 mtpp -55.98 -35.25 66.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 110.629 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.05 -32.0 64.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.743 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.56 72.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.071 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.408 ' HA ' HG12 ' A' ' 445' ' ' ILE . 42.5 t -62.96 -39.21 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -38.56 85.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.517 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -35.45 80.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.353 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.408 HG12 ' HA ' ' A' ' 442' ' ' VAL . 2.5 mm -65.78 -31.2 52.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.707 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -44.45 85.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.442 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.62 -38.44 91.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.839 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 15.9 mt -74.67 -36.29 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.878 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.2 -51.64 68.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.675 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.47 -33.99 77.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 0.0 110.098 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -59.65 -31.71 69.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.848 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.445 ' HG ' ' CG1' ' A' ' 397' ' ' VAL . 0.4 OUTLIER -73.14 -36.61 66.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.448 179.265 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.21 -30.0 61.72 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.974 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -13.57 23.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.367 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -82.06 -26.26 33.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.171 0.51 . . . . 0.0 110.916 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.66 -97.97 0.74 Allowed Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.598 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.848 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.519 -0.232 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . 0.46 ' O ' HG22 ' A' ' 383' ' ' ILE . 30.6 mm -58.67 -29.9 40.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.403 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.79 -33.26 66.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.865 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -65.82 -41.16 92.16 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.325 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . 0.487 HG22 ' CD1' ' A' ' 384' ' ' ILE . 5.4 tp -60.68 -32.41 51.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.487 ' CD1' HG22 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -75.02 -44.78 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.714 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.98 -49.36 75.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.882 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 10.4 p -63.87 -37.34 79.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.861 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.4 tp -67.56 -37.73 83.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.67 -34.67 77.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.744 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -44.58 78.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.25 -35.95 74.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.136 0.493 . . . . 0.0 110.384 179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.32 -41.06 88.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.486 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.95 -42.87 99.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.303 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -38.08 76.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.447 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -59.37 -42.69 92.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.1 -41.1 82.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.779 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 49.3 mm-40 -69.27 -44.51 71.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.971 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 45.5 t -60.59 -33.45 54.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.532 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -57.01 -34.78 68.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.993 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.0 tt0 -89.99 -67.46 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.764 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.521 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 8.2 t80 43.4 111.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.805 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 9.8 m -95.76 23.6 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.157 178.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.521 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.69 -171.46 42.26 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.582 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.455 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.07 143.77 48.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.685 0.279 . . . . 0.0 111.666 -179.696 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.516 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.94 -25.56 30.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.214 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.05 0.37 37.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.436 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -92.14 149.5 21.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.34 . . . . 0.0 110.635 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.767 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.14 -30.16 70.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.852 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.82 -29.17 70.52 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.103 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.516 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.3 t80 -69.57 -45.56 68.41 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.767 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 4.8 p-90 -72.85 -30.99 64.45 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.961 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.609 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 36.6 tp -69.67 -38.4 77.03 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.471 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.471 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 11.2 tp -61.66 -47.34 85.81 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -70.41 -32.7 70.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.304 177.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.609 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mt-10 -64.01 -35.67 81.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.442 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 28.3 ttp -69.6 -40.66 76.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.653 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 1.9 mp -60.62 -45.74 92.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -33.45 75.11 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.643 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -59.41 -47.27 86.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.358 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -69.75 -38.11 76.67 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.35 -39.47 90.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.247 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.34 -31.84 69.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.782 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -46.21 91.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.781 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.24 -35.07 77.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.824 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.12 -31.26 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.803 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.8 t -60.31 -20.79 60.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 22.7 t -66.49 116.77 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.087 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.54 113.72 25.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.959 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 7.4 t -107.87 133.21 52.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -96.24 34.64 4.82 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.482 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 108.69 69.94 0.67 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.426 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -143.19 114.5 7.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.937 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -65.81 -35.27 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 42.2 t -60.14 -44.66 94.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 27.8 t -71.13 -42.89 75.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.995 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -67.78 -35.5 78.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.09 -35.26 76.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.853 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.13 76.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.136 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.63 -43.86 75.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.935 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -59.04 -44.83 91.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.767 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -62.48 -36.28 82.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.645 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.42 76.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.002 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 34.2 t -63.11 -45.9 97.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.051 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.91 -34.56 74.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.083 0.468 . . . . 0.0 110.322 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -63.18 -35.74 81.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.339 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . . . . . . . . . 2.6 mm -66.13 -35.51 75.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.473 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -58.25 -47.78 82.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.089 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.63 -37.07 85.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.966 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 7.8 mt -74.78 -36.5 40.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.144 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.39 -54.11 50.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.926 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -38.62 91.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.354 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . 0.438 ' O ' ' HD2' ' A' ' 455' ' ' LYS . 3.7 mttm -57.87 -35.19 70.64 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.46 -36.76 83.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.397 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.7 -29.91 70.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.789 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.71 -16.25 25.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.845 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.438 ' HD2' ' O ' ' A' ' 451' ' ' LYS . 0.3 OUTLIER -82.46 -22.6 35.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.797 0.332 . . . . 0.0 110.776 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.08 -79.77 0.67 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.374 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.835 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 96.7 p . . . . . 0 CA--C 1.518 -0.276 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 46.0 mm -58.65 -29.81 40.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 178.489 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.405 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.09 -33.35 67.21 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.052 -179.84 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -68.25 -38.21 81.55 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.099 0.476 . . . . 0.0 110.873 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 21.6 mt -60.54 -34.98 60.35 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.399 178.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.436 HD12 ' N ' ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.97 -44.72 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.426 178.615 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.04 -49.32 76.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.768 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 19.9 t -67.06 -39.34 83.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.012 179.838 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 4.2 tt -67.13 -35.65 80.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.474 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -62.71 -34.72 77.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.672 178.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.02 -34.6 73.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.424 179.704 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 32.6 t -67.7 -46.87 81.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.096 179.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -59.46 -41.03 88.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.946 0.403 . . . . 0.0 110.538 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.37 -37.39 77.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.231 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.97 -38.66 91.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.381 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -59.11 -45.07 91.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.461 179.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -60.98 -33.52 73.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.631 179.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.25 -40.7 77.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.813 179.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 24.4 t -60.68 -33.27 54.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.472 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -28.51 64.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.174 0.512 . . . . 0.0 110.135 178.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 24.3 tt0 -91.69 -53.39 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.886 179.119 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.66 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 46.1 t80 -20.78 112.64 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.231 179.823 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.8 p -104.07 26.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.619 178.243 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.66 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -58.91 -177.66 0.93 Allowed Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.781 -0.724 . . . . 0.0 113.065 -179.309 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.518 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.62 48.22 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.834 -0.683 . . . . 0.0 111.543 -179.999 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.43 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -52.56 -27.15 15.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.319 179.355 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.5 -15.55 20.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.493 -179.707 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -74.52 144.17 44.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.747 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.1 OUTLIER -62.81 -30.83 71.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.813 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.09 70.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.803 179.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.518 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 41.2 t80 -68.36 -45.58 72.43 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.747 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -72.94 -29.37 63.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.949 177.921 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.61 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 20.2 tp -69.61 -38.43 77.26 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.14 177.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -47.32 85.86 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 3.7 tt0 -70.63 -32.26 69.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.646 177.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.61 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.87 -38.97 93.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.198 -179.367 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.504 ' O ' ' HG3' ' A' ' 418' ' ' LYS . 50.3 ttp -69.64 -44.79 69.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.339 . . . . 0.0 110.859 -179.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.49 -37.11 77.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.505 179.641 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 417' ' ' THR . . . . . 0.434 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 1.2 t -70.26 -44.28 68.77 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -61.68 -38.61 88.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.726 0.298 . . . . 0.0 110.931 -179.627 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -72.27 -46.33 56.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.11 179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.434 ' CD2' ' HA ' ' A' ' 417' ' ' THR . 1.7 pp -66.61 -34.29 77.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.5 -38.44 89.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.937 179.249 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.89 -44.3 97.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.298 179.51 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.06 -38.08 85.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.708 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.04 -26.47 65.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.009 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 4.3 p -96.8 38.33 1.23 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.931 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 10.9 p -88.92 133.53 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.45 98.68 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.8 t -114.22 129.55 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.947 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -158.46 100.06 0.19 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.462 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.21 49.89 54.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.458 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . 0.433 ' O ' HG11 ' A' ' 434' ' ' VAL . 32.4 mt-30 -152.2 108.63 3.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.867 0.365 . . . . 0.0 110.926 179.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.69 -28.82 68.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.5 m -59.8 -44.93 93.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.724 -179.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . 0.433 HG11 ' O ' ' A' ' 431' ' ' GLN . 10.8 p -72.44 -35.25 51.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 111.328 -179.588 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -42.44 94.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.803 0.335 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -69.29 -32.88 72.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.43 -45.23 63.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.199 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -68.36 -35.08 77.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.775 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -66.24 -35.79 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.793 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.6 -45.42 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.23 95.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.546 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 24.5 t -63.33 -31.34 52.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.83 -46.7 62.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.98 179.774 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -67.01 -44.69 79.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.218 -179.796 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.546 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.0 pp -63.3 -31.08 51.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.98 0.419 . . . . 0.0 110.937 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.09 -44.62 91.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.584 179.692 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.13 77.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.284 -179.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 22.0 mt -73.3 -36.59 49.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.174 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.57 -57.64 11.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.026 -179.768 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -33.18 74.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.744 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -31.88 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.976 0.417 . . . . 0.0 110.365 179.6 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.412 ' CD1' ' CD2' ' A' ' 416' ' ' LEU . 2.7 mt -77.61 -36.63 51.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.796 179.619 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -56.04 -30.01 61.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.769 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -90.35 -22.43 21.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.737 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -19.2 39.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.031 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.03 -98.9 0.14 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.483 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.89 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 10.7 p . . . . . 0 CA--C 1.518 -0.256 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 33.2 mm -58.6 -29.76 40.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.547 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -59.35 -33.32 71.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.811 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -68.09 -38.07 81.93 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.246 0.546 . . . . 0.0 110.764 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 387' ' ' LEU . 40.1 mm -60.48 -33.95 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.477 178.945 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -74.94 -44.49 44.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.169 178.293 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -56.82 -45.98 81.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.696 179.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 13.5 p -69.36 -44.16 80.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.695 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 383' ' ' ILE . 0.3 OUTLIER -66.12 -35.11 79.62 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.745 179.87 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.81 -34.98 78.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.304 0.573 . . . . 0.0 109.526 178.784 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -67.16 -40.78 86.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.591 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . 0.572 HG12 ' N ' ' A' ' 391' ' ' GLN . 4.3 p -63.17 -35.62 72.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.817 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.572 ' N ' HG12 ' A' ' 390' ' ' VAL . 1.0 OUTLIER -63.22 -41.07 99.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.816 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -64.23 -44.96 90.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.69 -40.6 84.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.986 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -60.15 -39.44 86.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.944 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -36.24 82.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.132 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.48 -40.62 85.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.093 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 18.1 t -60.68 -39.19 80.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.65 -40.37 75.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.979 0.418 . . . . 0.0 110.388 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' C ' ' A' ' 400' ' ' PHE . 17.6 tt0 -77.34 -54.86 5.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.169 179.35 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.512 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 41.8 t80 -11.76 110.92 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.525 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 p -104.49 24.92 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.515 178.193 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.512 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -64.4 -169.05 1.71 Allowed Glycine 0 N--CA 1.442 -0.925 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.873 -179.347 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.564 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.86 143.55 48.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.351 -0.424 . . . . 0.0 111.253 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.438 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -52.79 -24.07 8.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.781 179.853 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 -5.03 21.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.521 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.45 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 24.3 t70 -77.84 156.13 30.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.773 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 41.0 mtmt -68.97 -32.87 72.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.292 179.587 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' A' ' 411' ' ' LEU . . . -62.83 -29.2 70.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 178.924 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.564 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 19.8 t80 -63.04 -45.23 93.23 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.827 -179.118 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.773 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.6 OUTLIER -72.62 -27.91 62.44 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 118.763 -1.175 . . . . 0.0 108.74 177.83 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.7 mp -66.48 -41.53 88.84 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.28 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.464 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.82 -46.78 88.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.813 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . 0.403 ' CG ' ' CD2' ' A' ' 449' ' ' LEU . 2.1 tm-20 -70.23 -31.94 69.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.593 177.921 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.555 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.0 OUTLIER -63.49 -42.22 98.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.339 -179.059 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 4.1 mmt -69.53 -44.33 71.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.078 0.466 . . . . 0.0 110.622 179.622 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.413 HD12 ' CD1' ' A' ' 412' ' ' LEU . 4.3 mt -61.68 -44.34 97.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 23.7 m -62.58 -30.46 71.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 -179.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . 0.457 ' O ' HD11 ' A' ' 421' ' ' LEU . 14.7 mttt -64.31 -43.39 94.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.062 0.458 . . . . 0.0 110.261 179.42 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.73 -37.78 67.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.991 179.178 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.4 ' HB2' ' CB ' ' A' ' 445' ' ' ILE . 0.3 OUTLIER -66.86 -50.51 62.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.385 -179.812 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . 0.478 ' CD1' ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.33 -31.5 68.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.986 -179.567 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . 0.478 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 0.8 OUTLIER -59.64 -46.34 89.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.781 0.324 . . . . 0.0 110.883 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.4 -31.02 71.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.991 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.07 -0.82 41.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.535 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 33.8 p -79.51 -37.25 37.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.825 0.345 . . . . 0.0 110.971 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 27.6 m -74.21 133.77 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.166 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -86.56 -22.22 26.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.069 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.5 t 43.53 85.52 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.525 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.21 46.98 1.64 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.449 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 144.92 52.57 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.465 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -164.14 95.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.86 0.362 . . . . 0.0 110.912 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -65.87 -33.93 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.867 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 27.9 t -59.15 -37.45 77.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 30.8 t -74.43 -41.9 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.088 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . 0.402 ' HA ' ' HD3' ' A' ' 438' ' ' ARG . 0.0 OUTLIER -59.61 -44.25 93.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 -179.983 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -67.47 -35.76 79.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.046 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . 0.408 ' CB ' ' CG2' ' A' ' 383' ' ' ILE . . . -73.11 -45.12 58.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.471 -179.767 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 438' ' ' ARG . 0.1 OUTLIER -66.17 -40.11 90.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.947 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -36.12 82.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.707 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.06 -42.82 62.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.811 179.784 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.56 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 43.2 t -65.11 -46.04 92.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.966 0.412 . . . . 0.0 110.813 179.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 8.7 m -61.97 -35.14 77.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.522 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . 0.419 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.1 -38.03 89.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.389 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.467 ' N ' HD12 ' A' ' 445' ' ' ILE . 1.5 mp -67.08 -31.32 52.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.05 -45.79 90.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.712 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.5 -37.62 85.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 444' ' ' LYS . 10.1 mt -70.34 -36.41 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.805 179.699 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . 0.403 ' CD2' ' CG ' ' A' ' 413' ' ' GLU . 20.0 mt -57.19 -50.22 73.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.63 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.42 -41.85 75.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 110.123 179.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.83 -30.04 65.44 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.544 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 11.4 tp -71.25 -36.64 71.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.323 179.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -56.31 -29.93 61.9 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.587 179.45 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -89.91 -17.13 28.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.904 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -22.41 35.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.717 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.09 -81.61 0.43 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.151 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 2.5 pp . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.947 179.851 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 CA--C 1.521 -0.149 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 3.2 mt -58.82 -30.11 41.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.609 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.416 ' HA ' HG12 ' A' ' 384' ' ' ILE . 6.5 mmmt -57.04 -33.23 67.01 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.867 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -38.09 83.69 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.154 0.502 . . . . 0.0 110.808 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 39.4 mm -60.44 -34.33 57.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.445 178.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.432 ' N ' HD12 ' A' ' 384' ' ' ILE . 0.3 OUTLIER -74.86 -44.72 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.396 178.517 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -57.37 -49.1 77.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.573 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.97 -40.74 88.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.824 179.634 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.402 ' O ' ' CG1' ' A' ' 390' ' ' VAL . 3.2 tt -66.01 -35.06 79.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.906 0.384 . . . . 0.0 110.622 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -34.97 78.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.905 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -67.75 -39.54 84.17 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.604 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . 0.568 HG12 ' N ' ' A' ' 391' ' ' GLN . 4.3 p -64.48 -35.57 74.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.483 179.635 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.568 ' N ' HG12 ' A' ' 390' ' ' VAL . 1.0 OUTLIER -61.77 -41.02 97.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.349 179.596 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -67.81 -46.52 71.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.491 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 42.7 mt -62.11 -37.97 87.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.487 179.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -37.36 79.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.645 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -64.04 -42.39 97.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.606 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -69.04 -40.19 78.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.715 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . 0.404 ' O ' ' HE3' ' A' ' 455' ' ' LYS . 22.1 t -60.6 -36.71 72.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.672 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.61 -35.75 66.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.175 0.512 . . . . 0.0 110.107 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -90.07 -66.83 0.89 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.813 178.998 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.559 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 9.6 t80 31.21 108.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 179.292 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 17.4 t -95.49 25.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.165 178.177 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.559 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -87.03 -174.83 49.15 Favored Glycine 0 N--CA 1.442 -0.914 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.683 -179.719 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.7 OUTLIER -134.21 143.69 48.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.603 -0.299 . . . . 0.0 111.755 -179.787 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.491 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.1 -25.62 32.55 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.083 179.151 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.4 m -105.33 14.51 28.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.223 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.75 151.84 24.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.763 179.831 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.725 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.1 -30.26 70.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 -179.827 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -64.4 -29.28 70.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 179.828 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.491 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 3.5 t80 -71.17 -45.67 62.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.369 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.725 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.1 p-90 -73.07 -29.62 63.09 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.849 177.908 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -69.65 -40.75 76.31 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.768 177.994 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.474 HD23 ' CD2' ' A' ' 400' ' ' PHE . 1.6 tp -61.97 -46.97 86.93 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.078 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.37 -32.2 69.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.758 177.961 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.57 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 1.3 mm-40 -63.61 -38.66 91.95 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.91 -179.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 42.9 ttp -69.6 -41.59 75.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.994 0.426 . . . . 0.0 110.28 179.332 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.29 -45.1 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.684 179.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 2.0 m -62.73 -32.59 73.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.712 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -61.46 -42.82 99.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.537 179.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -67.49 -46.4 73.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.282 179.614 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -59.87 -38.53 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.441 179.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.9 mp -64.88 -31.8 73.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.56 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.07 -46.27 88.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 37.3 mt -65.34 -33.99 77.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.869 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -5.18 54.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.3 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 32.2 t -89.37 10.64 21.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.609 0.242 . . . . 0.0 111.374 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 30.0 t -93.54 115.6 32.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.855 0.36 . . . . 0.0 110.912 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -82.14 87.69 6.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.905 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 9.9 t -73.79 149.81 41.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.845 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -127.66 41.31 1.61 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.518 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.11 -27.47 4.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.528 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 47.7 tp60 -58.53 92.48 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 0.0 111.043 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -66.44 -29.71 69.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.1 m -57.74 -44.15 85.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.984 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 29.5 t -64.86 -36.88 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.061 -180.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -62.18 -40.91 97.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.858 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -36.13 77.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.87 -45.19 64.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.105 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -69.22 -35.06 75.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -65.46 -39.58 92.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.513 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.27 -38.0 89.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.566 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.0 -42.23 98.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.801 179.812 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.552 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 11.8 t -62.97 -32.51 56.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.833 179.83 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.67 -40.59 72.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.777 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -72.97 -44.59 60.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.856 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.552 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.8 pp -64.66 -31.09 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.076 0.465 . . . . 0.0 110.624 179.575 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.15 -44.03 85.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.449 179.7 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.3 -37.35 80.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.948 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 29.7 mt -70.99 -36.51 63.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.863 179.737 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -53.22 60.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.942 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.99 -41.07 91.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.466 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.79 -30.6 65.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 4.1 tp -70.37 -36.48 74.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.334 179.124 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -29.73 61.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.598 179.565 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.5 -12.19 30.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.475 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' A' ' 397' ' ' VAL . 0.0 OUTLIER -82.44 -25.55 33.53 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.896 0.379 . . . . 0.0 110.484 179.708 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.39 -73.7 1.15 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.395 179.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . 0.406 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.852 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.19 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 31.8 mm -58.75 -29.93 41.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.773 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.422 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -56.92 -33.27 66.78 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.583 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.34 -37.93 81.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.19 0.519 . . . . 0.0 110.473 179.473 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . 0.415 ' CD1' ' CZ ' ' A' ' 438' ' ' ARG . 19.4 mm -60.31 -33.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.441 178.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 384' ' ' ILE . 0.3 OUTLIER -74.88 -44.68 44.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.471 178.493 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -58.42 -49.36 77.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.686 179.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 77.6 t -65.94 -43.95 92.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.753 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.44 -35.8 78.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.898 0.38 . . . . 0.0 110.505 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 4.5 mt-10 -62.79 -34.92 78.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.232 0.539 . . . . 0.0 109.637 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.25 -34.52 72.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.569 179.669 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 36.8 t -62.42 -46.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.455 -179.714 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.8 pt20 -64.32 -36.34 83.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -34.99 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.188 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -37.91 82.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.261 179.429 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -39.1 79.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.615 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -39.2 80.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.458 179.659 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.4 -44.58 71.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.223 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 21.8 t -60.82 -47.49 93.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.414 -179.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.66 -29.91 64.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.696 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -87.57 -57.63 2.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.975 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.559 ' CE1' ' HG ' ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.76 128.75 36.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.905 -179.853 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 402' ' ' GLY . 29.4 m -124.37 40.55 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.414 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.524 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.97 -163.44 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.002 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.53 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.24 143.67 49.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.01 0.433 . . . . 0.0 111.44 -179.354 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.447 ' HA ' ' CE1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.23 -24.48 27.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.861 -179.888 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.69 14.03 24.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.352 -179.797 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . 0.527 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t0 -95.62 154.07 17.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.37 . . . . 0.0 111.171 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -71.36 -43.48 66.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.704 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.94 -33.1 74.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.535 179.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.53 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 4.0 t80 -67.59 -44.24 78.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.287 179.634 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.436 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -56.01 -48.44 75.9 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.43 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.548 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -60.11 -37.96 81.58 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.111 176.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.559 ' HG ' ' CE1' ' A' ' 400' ' ' PHE . 0.1 OUTLIER -59.4 -47.73 84.33 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.483 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -71.02 -32.64 69.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.53 177.432 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.16 -46.5 83.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 114.992 -1.003 . . . . 0.0 111.644 -179.312 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -64.56 -39.68 94.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.744 0.306 . . . . 0.0 110.856 -179.812 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.69 -38.41 84.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.926 0.393 . . . . 0.0 110.708 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.3 m -67.54 -38.53 84.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.114 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.09 -40.92 82.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.004 -179.853 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.5 -46.34 86.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.013 0.435 . . . . 0.0 110.136 179.635 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . 0.409 ' HB2' ' CD1' ' A' ' 445' ' ' ILE . 2.7 tm? -62.14 -37.34 84.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.442 179.422 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -70.5 -31.8 69.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -46.39 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.141 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.2 pp -67.91 -30.76 70.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.12 -179.842 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -83.92 11.33 7.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.595 -179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 26.9 t -100.27 -19.02 16.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.682 0.277 . . . . 0.0 111.359 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 29.8 m -66.61 137.84 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.903 0.382 . . . . 0.0 111.167 -179.79 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.86 149.04 29.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.931 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -148.06 118.08 7.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.927 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -78.52 -50.89 5.86 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.985 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -172.22 35.97 0.15 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.421 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.28 102.59 14.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.875 0.369 . . . . 0.0 110.895 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -60.14 -30.53 69.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.886 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -44.86 92.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.857 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 23.4 t -75.11 -42.48 44.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.985 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -63.08 -39.68 95.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.821 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -68.08 -37.58 81.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.08 -34.53 66.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.224 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . 0.415 ' CZ ' ' CD1' ' A' ' 383' ' ' ILE . 0.1 OUTLIER -69.83 -44.53 69.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.799 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 440' ' ' GLU . 0.0 OUTLIER -64.65 -31.5 72.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 110.509 179.661 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 8.7 tp10 -65.89 -40.06 91.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.52 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.58 92.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.631 179.7 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.536 ' HA ' HG12 ' A' ' 445' ' ' ILE . 12.3 t -62.95 -30.88 50.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.772 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -45.67 65.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.944 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -44.14 96.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.536 HG12 ' HA ' ' A' ' 442' ' ' VAL . 34.3 pt -64.8 -31.22 52.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.043 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . 0.416 ' N ' HG13 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -62.8 -40.95 98.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.223 179.733 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.51 -35.63 80.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.36 179.392 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 19.3 mt -74.8 -36.67 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.665 179.489 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.61 -47.54 81.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.626 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.2 -40.95 90.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.302 179.477 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -30.11 65.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.086 0.47 . . . . 0.0 109.894 178.956 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.403 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -76.25 -36.73 58.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.416 179.392 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -41.53 93.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -78.96 -20.99 47.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.186 -179.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.42 -19.97 37.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.902 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.33 -88.44 0.35 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.478 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.516 -0.332 0 CA-C-O 120.653 0.263 . . . . 0.0 111.611 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 3.0 mp -58.66 -29.53 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.704 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 381' ' ' LYS . . . . . 0.42 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.8 -33.4 66.63 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.796 179.838 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -68.32 -37.97 81.08 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.221 0.534 . . . . 0.0 110.505 179.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 48.6 mt -60.45 -33.96 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.408 178.827 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 384' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.3 OUTLIER -74.95 -44.67 44.51 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.194 178.424 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -59.49 -49.34 78.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.602 179.721 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 13.7 p -63.83 -35.45 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.368 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.9 tt -67.44 -34.29 76.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.262 179.454 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 388' ' ' GLU . . . . . 0.404 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 0.3 OUTLIER -62.76 -35.15 78.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.601 179.017 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -35.43 73.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.569 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 32.9 t -69.25 -46.82 76.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 391' ' ' GLN . . . . . 0.404 ' HG2' ' HA ' ' A' ' 388' ' ' GLU . 14.8 pt20 -58.36 -37.99 76.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.661 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -67.19 -42.86 83.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.435 179.556 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.34 -37.92 89.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.332 179.368 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -39.16 81.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.542 179.653 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -63.12 -43.22 99.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.46 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.22 -42.07 76.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.492 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 50.7 t -60.63 -32.17 50.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.398 179.472 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.7 -40.04 86.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.973 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.406 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.9 tt0 -86.51 -68.77 0.72 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.846 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.599 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 4.5 t80 57.13 144.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.16 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 11.9 t -125.98 21.62 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.916 178.701 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 402' ' ' GLY . . . . . 0.599 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -110.93 179.37 20.02 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.472 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 403' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.34 151.43 51.23 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.363 -0.419 . . . . 0.0 111.713 -179.618 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 404' ' ' LYS . . . . . 0.539 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.5 -31.91 25.58 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.128 179.233 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 8.9 t -97.2 15.67 22.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.196 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -115.23 155.06 27.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.848 0.356 . . . . 0.0 110.959 179.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 407' ' ' LYS . . . . . 0.773 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 4.0 mtmp? -61.72 -30.04 70.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.891 179.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.83 -29.24 70.58 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 409' ' ' TYR . . . . . 0.539 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 10.7 t80 -70.55 -45.81 64.77 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -178.61 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 410' ' ' TRP . . . . . 0.773 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -72.94 -29.12 62.86 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 118.804 -1.158 . . . . 0.0 108.888 177.979 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 411' ' ' LEU . . . . . 0.589 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 33.3 tp -69.59 -38.66 77.43 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.258 178.091 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.477 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 11.6 tp -62.15 -47.17 85.75 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.796 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.49 -32.14 69.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.732 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 414' ' ' GLU . . . . . 0.589 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.62 -46.59 85.04 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -178.982 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 415' ' ' MET . . . . . 0.488 ' HG3' HD11 ' A' ' 416' ' ' LEU . 2.5 ptt? -64.47 -38.72 92.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 110.272 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 416' ' ' LEU . . . . . 0.488 HD11 ' HG3' ' A' ' 415' ' ' MET . 8.7 mp -68.88 -37.17 78.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.632 179.233 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 81.4 m -67.15 -35.67 80.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -179.257 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 418' ' ' LYS . . . . . 0.455 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.1 OUTLIER -72.16 -34.54 68.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.573 0.225 . . . . 0.0 111.594 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 419' ' ' GLU . . . . . 0.437 ' N ' ' HG3' ' A' ' 418' ' ' LYS . 9.0 pt-20 -72.2 -41.99 66.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.675 0.274 . . . . 0.0 111.043 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 1.2 pp -67.49 -38.19 83.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.822 0.344 . . . . 0.0 110.755 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.32 -33.24 73.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.711 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -40.3 95.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.778 179.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -31.9 65.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.801 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -31.47 72.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.804 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 40.4 t -59.63 -26.47 65.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 40.6 t -66.63 126.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.23 176.43 7.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 3.9 t -162.59 160.28 25.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.864 179.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -146.87 85.91 0.17 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 65.49 28.26 73.4 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.481 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -106.81 94.47 5.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.804 0.335 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.99 -33.65 72.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -39.62 94.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.881 179.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 24.5 t -76.04 -46.17 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.104 -179.957 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.04 -40.32 95.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.842 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -69.32 -35.18 75.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.935 179.907 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.2 -45.18 57.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.456 -179.738 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.55 -40.02 84.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.884 -179.87 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.46 -44.87 85.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.026 0.441 . . . . 0.0 110.355 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -61.52 -31.6 71.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.285 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.28 -38.8 91.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.876 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 442' ' ' VAL . . . . . 0.415 ' O ' ' CG ' ' A' ' 446' ' ' GLN . 26.8 t -62.64 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 443' ' ' CYS . . . . . 0.642 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.3 m -60.7 -30.01 69.68 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 444' ' ' LYS . . . . . 0.424 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.55 -41.6 98.43 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.769 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 445' ' ' ILE . . . . . 0.405 ' N ' ' CD1' ' A' ' 445' ' ' ILE . 0.6 OUTLIER -73.67 -35.26 43.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.508 0.671 . . . . 0.0 109.821 178.669 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . 0.642 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.4 OUTLIER -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.285 179.438 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.47 -40.45 86.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.121 179.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 448' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 444' ' ' LYS . 10.1 mt -72.75 -36.15 51.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.21 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -41.54 78.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.027 -179.198 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.5 -42.77 67.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -29.97 65.62 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.612 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.438 ' HG ' HD21 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -71.32 -36.64 71.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.677 179.349 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.16 -29.86 61.4 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 454' ' ' LYS . . . . . 0.406 ' HA ' ' CE ' ' A' ' 454' ' ' LYS . 1.0 OUTLIER -98.41 -8.92 26.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.824 -179.809 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.52 -26.0 32.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 110.872 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -83.65 -73.57 1.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.276 -179.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.865 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 112.57 -0.212 . . . . 0.0 112.57 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.5 m -152.72 149.54 22.56 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.726 0.298 . . . . 0.0 110.926 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -69.11 -46.23 1.59 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.612 2.208 . . . . 0.0 112.274 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 55.91 172.74 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.05 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -114.22 156.92 23.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.81 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 61.9 104.73 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.426 ' HG2' HG13 ' A' ' 380' ' ' ILE . 59.2 Cg_exo -52.39 -174.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.65 2.233 . . . . 0.0 112.198 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.409 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 61.4 Cg_endo -80.59 -50.1 0.06 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.358 2.039 . . . . 0.0 113.289 -179.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 56.3 p -74.29 -26.16 60.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.676 0.274 . . . . 0.0 111.485 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.426 HG13 ' HG2' ' A' ' 377' ' ' PRO . 37.7 mm -58.68 -29.75 40.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.456 ' HA ' HG12 ' A' ' 384' ' ' ILE . 30.4 mttp -56.71 -33.23 66.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -37.95 84.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.078 0.466 . . . . 0.0 110.773 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.44 -34.71 58.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.483 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.456 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.9 -44.68 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.316 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.31 -43.72 88.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.279 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 42.5 t -70.31 -42.91 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.63 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.408 ' O ' ' CG1' ' A' ' 390' ' ' VAL . 0.4 OUTLIER -66.09 -35.09 79.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 179.657 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.86 -34.96 78.45 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -40.85 87.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.548 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.583 HG13 ' N ' ' A' ' 391' ' ' GLN . 4.3 p -63.59 -35.54 73.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.583 ' N ' HG13 ' A' ' 390' ' ' VAL . 1.0 OUTLIER -62.41 -40.97 98.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.513 179.655 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -70.44 -35.53 73.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.504 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.22 -38.56 90.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.516 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.66 -46.88 87.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.543 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.96 -32.52 73.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.603 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -38.25 78.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 21.7 t -60.69 -41.98 90.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.858 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -55.63 -34.55 65.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.02 0.438 . . . . 0.0 110.468 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -84.45 -54.34 4.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.153 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.584 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.8 t80 -27.42 112.55 0.06 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.001 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.9 p -105.13 26.81 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.53 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.584 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -57.64 -170.22 0.18 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.173 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.95 143.88 48.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.217 -0.492 . . . . 0.0 111.486 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -30.56 3.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.068 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.8 t -115.48 15.77 16.68 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 0.3 OUTLIER -83.11 150.49 26.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.871 0.367 . . . . 0.0 110.859 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -63.41 -30.66 71.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.213 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -73.17 -38.86 66.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.967 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.535 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 16.7 t80 -60.12 -44.36 94.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.566 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.471 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -58.92 -48.82 80.1 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.653 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.577 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -64.27 -38.05 89.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.421 ' HG ' ' CD2' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.58 -47.56 85.08 Favored 'General case' 0 CA--C 1.523 -0.089 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -32.64 69.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.223 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.18 -46.4 84.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.233 -179.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 17.3 ptp -62.85 -40.37 97.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.816 0.341 . . . . 0.0 110.861 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.407 ' O ' ' CG ' ' A' ' 419' ' ' GLU . 1.3 mt -63.33 -48.15 79.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.449 . . . . 0.0 110.541 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.7 m -64.82 -30.39 71.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -62.19 -47.3 85.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.129 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.407 ' CG ' ' O ' ' A' ' 416' ' ' LEU . 3.8 pt-20 -63.58 -34.81 78.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.027 0.442 . . . . 0.0 110.14 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.402 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 0.4 OUTLIER -69.01 -33.94 74.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.037 179.217 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.4 mp -70.34 -31.87 69.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.995 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.44 -46.38 60.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.814 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.47 -30.82 69.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.96 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -92.68 29.74 1.7 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.217 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.3 t -109.24 -17.16 13.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.958 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 13.5 m -66.59 137.34 25.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.12 -46.75 11.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.947 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 14.8 t 45.47 -167.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.358 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -169.65 -51.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.577 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.94 36.18 2.1 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.494 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -103.84 103.27 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.906 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.5 -39.69 85.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -40.95 86.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 39.1 t -69.8 -46.28 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.165 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -39.33 83.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.012 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -69.15 -45.12 70.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.141 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -69.11 -37.58 78.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.291 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -44.55 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.052 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 34.1 tttp -67.96 -43.17 79.64 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.197 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -64.08 -39.41 94.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.1 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.59 86.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.22 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 20.3 t -62.64 -35.45 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.86 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 6.8 m -63.08 -36.05 82.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.436 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -64.39 -41.71 96.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.706 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.36 -31.17 51.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -41.73 90.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.691 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.19 91.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.071 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 34.0 mt -73.61 -36.53 47.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.142 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -44.76 85.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.971 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.12 -40.93 67.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.852 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -30.93 66.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 110.067 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -36.64 51.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.565 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -56.15 -30.0 61.55 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.805 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 10.5 pttt -90.37 -16.58 28.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.266 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -82.46 -23.5 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.668 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.57 -91.87 0.23 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.478 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.873 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.422 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 1.1 m -178.98 -61.62 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 120.632 0.253 . . . . 0.0 110.939 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . 0.422 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 57.3 Cg_endo -71.28 90.31 0.68 Allowed 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.505 2.136 . . . . 0.0 112.294 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -82.9 -33.12 26.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 62.33 90.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 1.2 p -147.11 119.01 4.71 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.745 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -58.6 179.84 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.489 2.126 . . . . 0.0 112.298 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -89.29 -17.23 1.94 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.975 2.45 . . . . 0.0 113.358 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 19.9 m -103.6 -23.25 13.49 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 36.8 mm -58.65 -30.06 40.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -56.8 -33.26 66.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -68.38 -39.85 81.61 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 111.218 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . 0.432 ' O ' ' HB2' ' A' ' 387' ' ' LEU . 4.4 mt -60.6 -31.79 49.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.673 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.435 HD11 ' N ' ' A' ' 384' ' ' ILE . 0.4 OUTLIER -74.77 -44.3 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.44 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.16 178.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -56.37 -46.19 80.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.279 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 96.6 t -68.44 -37.3 77.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.138 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 383' ' ' ILE . 0.2 OUTLIER -67.52 -35.19 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.256 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -62.8 -35.0 78.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.67 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -38.81 88.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.285 179.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 24.2 t -69.74 -35.89 67.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.635 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -40.87 83.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.655 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -40.77 84.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.456 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -40.99 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.498 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -59.86 -35.33 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -49.2 74.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -69.25 -45.11 70.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.99 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . 0.407 HG12 ' CD1' ' A' ' 452' ' ' LEU . 23.6 t -61.38 -32.3 52.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 110.542 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -56.66 -37.05 70.26 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.239 0.543 . . . . 0.0 109.861 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -86.73 -67.7 0.8 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.671 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.531 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 4.0 t80 58.92 142.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.142 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 18.0 t -123.92 20.68 4.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.093 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.531 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -115.89 178.57 17.62 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.402 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.471 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -134.19 157.03 47.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.884 0.373 . . . . 0.0 111.603 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.586 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.5 -31.71 56.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.661 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.6 t -89.77 9.48 27.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.791 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.471 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 1.8 m-20 -115.09 164.81 13.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.336 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.715 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.8 mmtm -69.66 -29.87 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.482 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -62.54 -29.23 70.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.579 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.586 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 22.9 t80 -71.64 -45.89 60.68 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.129 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.715 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.9 OUTLIER -73.14 -31.59 64.37 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.716 177.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.604 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.3 tp -67.8 -38.41 83.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.046 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.455 ' CD2' ' CG ' ' A' ' 400' ' ' PHE . 21.3 tp -60.85 -47.28 87.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -70.67 -32.02 69.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.795 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.604 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.57 -46.21 86.95 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.008 -179.112 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -64.49 -37.56 87.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.977 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 5.0 tp -65.95 -37.19 85.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.253 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 29.8 m -62.53 -40.35 96.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.888 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -60.52 -47.31 86.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.854 0.359 . . . . 0.0 110.489 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -72.17 -35.83 69.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.2 0.524 . . . . 0.0 109.809 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 0.1 OUTLIER -61.97 -39.56 92.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.979 179.162 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.72 -31.79 68.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.073 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.04 -46.52 89.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.193 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 420' ' ' LEU . 4.0 pp -74.45 -30.97 62.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -98.81 30.95 3.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.859 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.2 t -108.25 -16.01 14.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 5.6 m -66.53 127.34 27.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.864 0.364 . . . . 0.0 111.123 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -84.79 -41.73 15.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.9 p 55.89 -174.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.021 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -178.05 50.64 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.22 -28.92 4.21 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.454 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.17 92.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.31 -35.61 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 20.5 p -61.81 -38.71 89.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 31.0 t -76.07 -36.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.056 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -40.99 94.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.88 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -69.22 -36.69 77.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.21 -45.1 58.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.417 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 439' ' ' LYS . 0.0 OUTLIER -65.17 -39.77 93.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.936 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 438' ' ' ARG . 0.0 OUTLIER -63.99 -43.42 95.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.601 179.818 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -32.31 71.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.696 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . 0.442 ' O ' HG12 ' A' ' 445' ' ' ILE . . . -66.9 -45.45 77.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.194 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.532 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 23.2 t -62.89 -30.78 50.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.111 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 4.0 t -67.35 -40.64 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.917 0.389 . . . . 0.0 110.48 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -44.73 78.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.087 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.532 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 9.4 pt -65.35 -31.23 52.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.916 0.388 . . . . 0.0 110.873 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.18 -47.78 84.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.725 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.67 80.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 21.4 mt -66.88 -36.6 77.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.718 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.45 -51.52 69.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.675 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -61.93 -30.47 70.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 110.336 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.39 75.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.075 0.464 . . . . 0.0 109.992 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.412 ' CD2' HD21 ' A' ' 412' ' ' LEU . 4.9 mp -70.81 -36.8 73.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.287 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -56.16 -29.84 61.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.187 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -101.19 -16.57 16.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.544 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -22.23 35.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.709 0.29 . . . . 0.0 110.95 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.36 -86.39 0.61 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.381 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.881 179.943 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.449 -0.261 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 90.7 p -82.52 144.48 49.43 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.669 0.271 . . . . 0.0 110.879 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -82.19 51.39 3.77 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.732 2.288 . . . . 0.0 112.58 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 52.2 39.94 27.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.866 0.365 . . . . 0.0 111.105 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 63.27 -79.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.889 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.94 113.63 57.78 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.742 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.426 ' HG2' HG13 ' A' ' 380' ' ' ILE . 76.2 Cg_exo -49.98 170.12 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.542 2.162 . . . . 0.0 112.47 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.88 -52.21 1.36 Allowed 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.916 2.411 . . . . 0.0 113.231 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.7 p -74.32 -27.29 60.63 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.475 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.8 mm -58.65 -29.76 40.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 2.1 mmpt? -56.71 -32.97 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.103 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -66.1 -41.98 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.941 0.401 . . . . 0.0 111.529 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . 0.479 HG22 ' N ' ' A' ' 384' ' ' ILE . 7.8 tp -60.57 -31.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.547 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.479 ' N ' HG22 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.91 -44.82 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.696 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -58.56 -49.35 77.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.809 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.9 p -64.1 -42.89 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.8 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -33.5 76.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.681 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.87 -34.82 78.18 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.947 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.15 -43.38 87.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.487 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 28.0 t -61.97 -35.97 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.853 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.01 -41.07 97.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.808 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -68.27 -42.2 79.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.77 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.26 -38.22 85.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.717 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -60.38 -45.64 92.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.724 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -60.94 -35.68 77.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.808 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -69.34 -39.93 77.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.006 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 9.0 t -60.62 -39.71 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.842 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -40.31 72.04 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.435 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -76.88 -54.27 6.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.101 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.672 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.5 t80 -24.3 113.11 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.051 -0.977 . . . . 0.0 113.222 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 p -104.71 28.11 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.351 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.672 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -50.58 -179.96 0.03 OUTLIER Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.87 -0.605 . . . . 0.0 113.411 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.88 143.51 48.33 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.708 -0.746 . . . . 0.0 111.636 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -20.46 43.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.493 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.2 m -101.87 -14.33 17.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.751 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.409 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 23.7 t70 -77.47 151.44 34.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.769 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.9 OUTLIER -71.29 -32.02 68.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 179.788 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.89 -29.1 70.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.342 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.529 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 29.8 t80 -64.23 -45.4 88.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.797 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.769 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.3 p-90 -72.82 -27.84 62.2 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 118.826 -1.149 . . . . 0.0 108.677 177.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.3 mp -67.59 -41.37 84.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.521 177.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.466 ' HG ' ' CD2' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -61.35 -47.21 86.91 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.285 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -70.49 -32.37 69.85 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.483 177.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.83 -43.42 96.25 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.721 -179.676 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 18.7 ttt -69.66 -41.37 75.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.266 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -37.21 85.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.721 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 417' ' ' THR . . . . . 0.423 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 85.0 m -67.71 -30.31 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.91 -38.4 72.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.441 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 5.4 pt-20 -70.78 -37.95 73.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.556 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.424 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 4.2 pp -72.97 -33.32 65.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 110.851 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . 0.4 ' N ' ' CD1' ' A' ' 420' ' ' LEU . 1.1 tp -68.49 -32.24 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -71.1 -39.48 72.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.793 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 3.0 mt -58.56 -31.74 68.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.833 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.13 -25.04 17.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.082 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 38.3 t -55.44 -31.02 61.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.023 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 7.6 m -74.68 120.87 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.109 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -88.4 143.15 27.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 27.1 p -131.23 -170.51 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.883 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -147.86 -90.58 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.516 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -96.45 29.76 9.79 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 89.82 4.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -40.05 96.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.809 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.3 t -60.0 -41.03 91.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.827 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 32.1 t -71.4 -35.61 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.978 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . 0.415 ' HA ' ' HD3' ' A' ' 438' ' ' ARG . 0.1 OUTLIER -64.5 -43.54 93.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.716 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -69.19 -32.85 72.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.871 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.33 -45.13 61.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.863 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' ' 435' ' ' ARG . 14.5 ptm180 -64.12 -44.55 91.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.572 0.225 . . . . 0.0 111.333 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' A' ' 440' ' ' GLU . 1.5 pttt -63.72 -32.87 74.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.903 0.382 . . . . 0.0 110.576 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . 0.434 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 4.7 mm-40 -67.75 -31.24 71.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.533 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.2 73.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.798 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.559 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 21.2 t -62.86 -34.13 64.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 66.0 m -70.7 -43.52 68.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.732 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.87 -44.75 69.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.009 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.559 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.3 pp -63.89 -31.13 51.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.107 0.48 . . . . 0.0 110.697 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -39.88 90.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.341 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.56 81.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.055 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 19.3 mt -72.67 -38.33 58.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.76 -48.52 79.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.635 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -70.18 -37.17 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.638 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.89 -31.27 66.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.082 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.418 HD21 ' CE2' ' A' ' 400' ' ' PHE . 0.1 OUTLIER -76.23 -36.74 58.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.444 179.351 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.74 -29.91 65.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.602 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.11 -13.46 28.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.248 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -24.24 34.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.809 0.338 . . . . 0.0 110.6 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -79.11 -80.61 0.75 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.368 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.255 -0.878 . . . . 0.0 110.862 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 14.9 m -108.01 135.33 19.88 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.515 0.198 . . . . 0.0 110.87 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.66 130.22 12.43 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.508 2.139 . . . . 0.0 112.393 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -112.8 94.22 4.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.763 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -97.46 -41.44 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.084 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.67 170.6 9.18 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.057 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.47 ' HB3' ' HD2' ' A' ' 378' ' ' PRO . 35.0 Cg_exo -60.6 174.98 1.34 Allowed 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.703 2.268 . . . . 0.0 111.932 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 377' ' ' PRO . 6.2 Cg_endo -48.29 -77.29 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.874 2.383 . . . . 0.0 113.274 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 11.4 m -96.55 -18.14 20.0 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.4 mm -58.85 -30.09 41.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.229 0.538 . . . . 0.0 109.691 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 20.2 pttt -56.66 -33.01 65.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.932 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -65.07 -42.96 93.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.589 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . 0.495 HG22 ' N ' ' A' ' 384' ' ' ILE . 0.8 OUTLIER -60.57 -32.04 50.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.495 ' N ' HG22 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.88 -44.76 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.545 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -56.69 -47.31 80.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.692 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 37.2 t -65.43 -34.5 70.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.669 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.44 82.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.49 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -34.64 77.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.581 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -34.67 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.438 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 28.2 t -67.08 -46.76 83.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.019 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.36 -40.93 92.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.5 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -68.52 -38.77 81.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.302 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.91 -37.9 89.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.323 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -58.86 -44.0 90.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.457 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.5 -39.64 88.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.694 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -69.24 -40.05 78.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . 0.405 ' CG1' ' CG2' ' A' ' 448' ' ' ILE . 23.7 t -60.63 -36.98 74.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.68 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -38.31 70.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.203 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.501 ' O ' ' C ' ' A' ' 400' ' ' PHE . 18.2 tt0 -79.84 -55.46 4.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.043 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.593 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 20.4 t80 -4.71 109.12 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.404 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 23.3 m -101.47 25.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.692 178.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.593 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -67.36 -173.59 6.53 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.843 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.0 143.74 48.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.305 -0.447 . . . . 0.0 111.496 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.444 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -57.27 -24.3 53.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.903 179.147 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 7.6 m -103.84 13.33 33.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.204 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.71 149.24 28.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.791 0.329 . . . . 0.0 110.687 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.764 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.16 -30.09 70.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.97 0.414 . . . . 0.0 110.9 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.78 -29.15 70.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.012 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.46 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 3.0 t80 -68.01 -45.56 73.68 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.764 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.13 63.84 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.691 177.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.569 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -66.44 -40.05 89.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.423 177.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.425 ' HG ' ' CG ' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -60.83 -47.25 87.21 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.117 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.435 ' HA ' ' CD2' ' A' ' 416' ' ' LEU . 0.9 OUTLIER -70.73 -32.27 69.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.729 177.811 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.569 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.85 -45.26 90.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.636 -179.165 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.468 ' HA ' ' HG2' ' A' ' 418' ' ' LYS . 21.4 ptp -66.45 -44.79 81.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.748 0.309 . . . . 0.0 111.136 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.435 ' CD2' ' HA ' ' A' ' 413' ' ' GLU . 4.1 pp -69.26 -37.13 77.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.831 0.348 . . . . 0.0 111.073 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 98.5 m -73.61 -44.03 58.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.679 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -58.01 -37.96 75.25 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.599 -179.627 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.431 ' N ' ' HG3' ' A' ' 418' ' ' LYS . 19.0 pt-20 -72.27 -34.8 68.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.206 0.527 . . . . 0.0 109.651 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.98 -44.13 85.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.446 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.63 -34.07 75.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.78 -39.46 94.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.433 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 6.7 mt -60.21 -35.17 74.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.789 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.24 -28.85 57.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.061 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.3 m -57.01 -34.87 68.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.962 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.06 120.15 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.0 158.13 8.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.992 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 72.3 p -122.71 -72.69 0.67 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 71.9 -100.47 0.93 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.551 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -118.71 72.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.21 108.8 1.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.902 0.382 . . . . 0.0 110.823 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.57 -28.63 67.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.397 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.8 m -57.54 -44.97 85.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.685 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.11 -35.48 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.147 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -44.43 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.872 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -35.8 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.777 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.96 -32.13 65.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.99 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.72 -42.45 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.354 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 -36.64 84.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.567 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -42.57 99.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.81 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.57 92.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.915 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.55 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 22.2 t -63.96 -31.64 54.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.909 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 97.9 m -70.7 -46.78 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.924 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -44.76 76.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.55 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.4 pp -64.14 -31.13 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.792 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -46.58 88.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.152 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -63.08 -36.03 82.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.684 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . 0.405 ' CG2' ' CG1' ' A' ' 397' ' ' VAL . 17.6 mt -73.14 -36.54 50.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.806 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.49 -49.26 76.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.702 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -41.87 66.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.416 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.9 mmtp -57.88 -30.01 65.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.083 0.468 . . . . 0.0 110.007 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.72 -36.72 56.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.438 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -56.98 -29.9 63.65 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -96.52 -11.16 25.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.477 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.56 -24.69 33.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -94.66 -71.34 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.416 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.935 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 112.524 -0.23 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 22.4 t -63.22 111.07 4.3 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.537 0.208 . . . . 0.0 110.903 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.23 111.35 3.06 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.468 2.112 . . . . 0.0 112.253 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -119.4 131.75 55.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.946 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 60.81 173.86 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.896 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 1.6 p -145.13 151.26 47.92 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.942 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.415 ' CB ' ' CD ' ' A' ' 378' ' ' PRO . 58.4 Cg_exo -53.19 -175.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.646 2.23 . . . . 0.0 112.409 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.415 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 73.2 Cg_endo -88.63 -9.19 4.92 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.798 2.332 . . . . 0.0 113.555 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.65 -25.96 8.86 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.746 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . . . . . . . . . 3.2 mt -58.71 -29.77 40.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.434 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -56.8 -33.17 66.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.978 -179.815 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.48 -38.03 83.77 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.135 0.493 . . . . 0.0 110.745 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 40.8 mm -60.44 -33.58 54.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.63 178.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.4 OUTLIER -74.74 -44.41 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.411 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -56.57 -45.12 81.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 57.8 t -66.13 -39.63 84.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.162 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.58 -32.57 73.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.292 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -35.14 79.18 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -38.06 74.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.184 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.9 p -70.38 -37.7 71.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.582 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.416 ' N ' HG11 ' A' ' 390' ' ' VAL . 15.6 pt20 -66.9 -40.97 87.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.841 0.353 . . . . 0.0 110.624 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -40.75 75.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.468 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.04 -38.65 89.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.426 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -59.63 -47.32 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.676 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -36.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.659 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -69.32 -37.5 77.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.096 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 25.6 t -60.53 -45.64 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.218 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -55.49 -31.92 62.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.915 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -87.4 -54.39 4.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.52 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.662 ' CZ ' ' HA2' ' A' ' 402' ' ' GLY . 4.1 t80 -48.11 113.54 0.76 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.741 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . 0.468 ' O ' ' O ' ' A' ' 402' ' ' GLY . 28.7 m -47.68 -31.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.881 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.662 ' HA2' ' CZ ' ' A' ' 400' ' ' PHE . . . 37.4 106.7 0.01 OUTLIER Glycine 0 C--O 1.228 -0.264 0 N-CA-C 114.679 0.632 . . . . 0.0 114.679 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.25 143.0 48.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.039 0.447 . . . . 0.0 110.893 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.472 ' HG2' ' CB ' ' A' ' 457' ' ' LEU . 0.2 OUTLIER -60.09 -22.18 62.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.217 179.764 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.99 1.1 51.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.35 135.64 53.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.917 0.389 . . . . 0.0 110.564 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.695 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 10.9 mtmt -61.01 -29.87 69.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.641 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 412' ' ' LEU . . . -62.71 -28.97 70.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.054 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 38.5 t80 -67.23 -45.85 75.55 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.695 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -73.05 -30.27 63.59 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 118.824 -1.15 . . . . 0.0 108.934 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.566 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.0 tp -69.63 -38.45 77.22 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.743 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.461 ' CD2' ' CD2' ' A' ' 400' ' ' PHE . 0.3 OUTLIER -62.31 -47.16 85.49 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -70.64 -32.81 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.408 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.1 mt-10 -64.1 -43.6 94.85 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.824 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 39.2 ttm -69.59 -35.26 75.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.659 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 11.3 tp -63.41 -48.08 79.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.818 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 52.7 m -65.01 -30.46 71.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.066 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -47.34 85.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.259 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 2.9 pt-20 -67.21 -36.16 81.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.406 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 3.1 tm? -67.74 -34.64 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.001 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.22 -31.9 69.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -43.0 98.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.772 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -31.15 58.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.014 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -76.64 -14.19 60.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 5.8 m -84.58 -25.79 28.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.768 0.318 . . . . 0.0 111.143 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.6 137.73 24.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.167 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.9 164.55 25.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.0 t -178.48 126.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.71 -84.97 1.78 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.439 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.89 38.09 1.86 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.473 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . 0.403 ' HB3' HG21 ' A' ' 434' ' ' VAL . 0.5 OUTLIER -91.77 123.82 35.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 110.892 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -67.69 -28.65 67.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.076 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.6 t -67.17 -44.85 78.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.675 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . 0.403 HG21 ' HB3' ' A' ' 431' ' ' GLN . 21.4 m -75.47 -37.59 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.733 0.301 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 40.1 mtt180 -67.66 -44.65 77.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.911 0.386 . . . . 0.0 110.697 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -69.41 -34.46 74.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.94 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.24 -45.22 57.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.513 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -39.12 92.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.781 0.324 . . . . 0.0 110.884 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -35.21 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.529 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.38 -35.89 80.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.09 -45.43 93.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.897 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.533 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 24.3 t -62.96 -33.29 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.752 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.2 m -70.73 -45.23 65.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.506 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -44.65 77.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.062 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.533 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.8 pp -63.37 -31.03 51.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -65.1 -41.54 94.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.508 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.49 -40.2 92.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 41.6 mt -67.7 -36.66 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -46.99 83.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.698 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -40.58 68.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.536 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -30.6 66.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.025 0.44 . . . . 0.0 109.967 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.59 -36.76 51.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.264 179.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.5 -29.94 69.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.629 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -86.64 -18.8 30.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.427 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 402' ' ' GLY . 0.0 OUTLIER -82.25 -25.93 33.65 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.453 ' O ' ' CD1' ' A' ' 457' ' ' LEU . . . -130.42 -115.96 1.8 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . 0.472 ' CB ' ' HG2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.03 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.174 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.41 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 0.3 OUTLIER -178.5 -61.78 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.626 0.251 . . . . 0.0 110.93 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 56.6 Cg_endo -70.62 149.45 61.39 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.466 2.111 . . . . 0.0 112.289 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -159.54 -51.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.001 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -132.58 96.15 3.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.09 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.2 123.97 67.51 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.737 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.609 ' HG2' HG13 ' A' ' 380' ' ' ILE . 52.7 Cg_exo -56.85 172.53 0.73 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.563 2.175 . . . . 0.0 112.394 -179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -77.85 -54.8 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.056 2.504 . . . . 0.0 113.597 -178.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 66.0 m -85.98 -22.66 27.23 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.609 HG13 ' HG2' ' A' ' 377' ' ' PRO . 43.8 mm -58.63 -29.77 40.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.434 ' HA ' HG12 ' A' ' 384' ' ' ILE . 27.3 mtmm -56.92 -33.16 66.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.06 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -67.92 -37.97 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.133 0.492 . . . . 0.0 110.694 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 37.5 mt -60.55 -33.6 55.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.41 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.77 -44.65 45.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.237 178.477 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -49.38 77.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.669 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 14.5 p -65.47 -45.02 94.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.38 -33.41 75.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.8 -35.05 78.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.741 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.38 -40.26 93.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.286 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 24.6 t -64.35 -37.01 78.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 -41.15 89.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -63.42 -38.52 91.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.455 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -38.03 89.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.93 -42.79 90.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.639 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.95 -40.3 92.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -69.12 -45.26 70.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.777 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 23.1 t -60.65 -36.91 73.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.705 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -58.42 -40.36 82.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.101 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -84.16 -67.55 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.577 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 18.6 t80 21.96 107.83 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 20.4 t -95.79 25.93 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.065 178.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.577 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -84.88 -176.8 50.95 Favored Glycine 0 N--CA 1.441 -0.99 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.732 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.25 143.81 48.02 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.404 -0.398 . . . . 0.0 111.628 -179.73 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.479 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -58.6 -23.52 58.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.82 0.343 . . . . 0.0 110.867 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 16.1 p -101.99 12.96 36.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.104 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.64 153.5 26.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.8 0.334 . . . . 0.0 110.873 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.801 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.2 mttt -61.15 -30.1 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.899 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.73 -29.19 70.49 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.508 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.479 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 3.7 t80 -72.06 -45.67 59.86 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.801 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -73.07 -29.36 62.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 118.841 -1.144 . . . . 0.0 108.9 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.551 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 15.8 tp -69.68 -41.32 75.61 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.428 178.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.465 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 8.0 tp -61.07 -46.71 89.56 Favored 'General case' 0 C--N 1.34 0.168 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 1.1 tt0 -70.2 -32.16 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.602 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.559 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 0.5 OUTLIER -63.9 -37.78 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.83 -179.652 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 5.9 ttt -69.75 -44.57 69.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.173 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 413' ' ' GLU . 4.4 pp -68.88 -37.01 78.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.791 0.329 . . . . 0.0 110.843 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 417' ' ' THR . . . . . 0.421 ' N ' ' CD1' ' A' ' 416' ' ' LEU . 90.4 m -62.58 -33.57 75.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.493 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -66.35 -47.46 73.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.138 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.51 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 0.3 OUTLIER -69.77 -34.7 74.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.51 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 6.2 tt -59.6 -44.42 93.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.864 178.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.51 -31.82 69.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.354 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.67 -46.88 87.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.427 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 420' ' ' LEU . 1.7 pp -74.55 -31.06 61.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.797 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.78 -19.46 61.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.116 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 35.5 t -95.3 35.38 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.197 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 34.1 m -97.78 131.92 43.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.127 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -91.85 128.15 37.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.1 t -113.94 145.31 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.92 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.29 66.46 0.55 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.439 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.35 74.49 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.495 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -97.22 114.03 25.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 0.0 110.844 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.79 -31.58 72.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 18.5 t -63.48 -44.42 94.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 21.8 t -68.47 -38.94 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.116 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -44.61 96.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.884 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -69.23 -35.64 76.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.851 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.19 -37.02 66.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.181 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.7 -44.69 61.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -34.09 75.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.879 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.13 -41.76 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . 0.448 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -63.75 -45.73 88.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.339 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 34.0 t -63.82 -32.81 58.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.873 0.368 . . . . 0.0 110.854 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.88 -43.57 98.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.588 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.21 -37.78 88.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 441' ' ' ALA . 14.7 mt -63.26 -33.21 59.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.106 0.479 . . . . 0.0 110.575 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.22 -47.72 83.19 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.752 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.58 70.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.862 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 41.6 mt -62.52 -37.07 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.643 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -52.93 63.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.647 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -39.53 86.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.525 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.4 ttpp -57.89 -30.12 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.209 0.528 . . . . 0.0 109.729 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.465 HD12 ' CE2' ' A' ' 400' ' ' PHE . 36.4 tp -72.82 -36.43 67.53 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.416 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.91 -29.9 60.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.221 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.36 -22.8 32.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.198 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.37 -21.89 35.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -69.07 -99.98 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.401 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.923 179.968 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 112.53 -0.228 . . . . 0.0 112.53 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 34.3 m -90.8 115.67 64.75 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.505 0.193 . . . . 0.0 110.911 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -67.33 -177.21 1.03 Allowed 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.408 2.072 . . . . 0.0 112.265 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 63.62 125.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -88.02 142.5 27.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 13.1 p -141.45 77.81 19.23 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.859 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.428 ' HD2' HG13 ' A' ' 380' ' ' ILE . 74.9 Cg_exo -51.46 -177.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.67 2.246 . . . . 0.0 112.626 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.89 -67.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.993 2.462 . . . . 0.0 113.097 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 24.0 m -63.9 -24.18 67.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.428 HG13 ' HD2' ' A' ' 377' ' ' PRO . 31.3 mm -58.71 -29.87 40.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.426 ' HA ' HG12 ' A' ' 384' ' ' ILE . 15.2 mtmt -56.96 -33.26 66.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.82 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -67.62 -38.02 83.33 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.128 0.489 . . . . 0.0 110.763 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 24.8 mt -60.48 -34.01 56.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.449 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.426 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.66 -44.78 46.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.204 178.445 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -48.53 81.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.468 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 14.5 p -67.45 -45.88 84.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.5 tt -64.59 -33.62 76.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.378 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -62.68 -35.06 78.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.704 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -39.18 91.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.1 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 40.5 t -66.81 -36.03 76.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.413 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -40.97 85.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.582 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -48.0 76.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.47 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 4.9 tt -60.88 -38.09 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.406 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -39.32 83.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.379 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -61.48 -40.51 94.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.427 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -68.11 -40.89 82.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.638 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.67 -30.5 47.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.693 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -61.99 -36.82 82.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.188 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -87.48 -67.75 0.8 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.215 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.562 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 5.5 t80 56.13 159.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.423 0.63 . . . . 0.0 111.915 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 m -142.26 20.49 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.056 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.562 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -108.18 -172.68 21.7 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.799 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.442 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.08 144.53 48.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.718 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.538 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.77 -28.6 15.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.124 179.238 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.7 t -102.68 15.89 28.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -115.44 157.69 23.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.92 0.39 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.813 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.8 tmtt? -61.18 -30.09 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.963 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.85 -29.13 70.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.632 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.538 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 11.0 t80 -75.18 -45.9 37.64 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.813 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -73.1 -31.99 64.69 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.68 -1.208 . . . . 0.0 108.61 177.779 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 38.7 tp -65.67 -41.11 92.84 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.093 177.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.474 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 30.4 tp -59.66 -46.73 88.14 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.18 -31.72 69.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.773 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.9 tm-20 -63.28 -43.39 98.04 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.983 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 9.7 mmt -67.06 -40.18 87.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 109.664 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.11 -37.36 82.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.645 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 3.6 m -62.84 -42.18 99.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.884 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -47.22 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.844 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 3.9 pt-20 -70.85 -34.78 72.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.372 . . . . 0.0 110.125 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.47 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 1.2 tt -61.61 -45.1 95.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.122 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.4 tp -70.21 -31.88 69.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.785 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -58.9 -46.29 88.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.837 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 1.2 mt -59.54 -31.42 69.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.806 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -100.47 29.18 4.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.913 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 57.6 m -107.96 -29.22 9.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 15.0 m -66.54 133.5 31.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.08 166.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.8 t -156.67 -45.84 0.07 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.914 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 75.01 -69.28 1.9 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.444 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -164.5 40.71 0.3 Allowed Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.425 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -96.38 119.56 35.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -63.11 -31.45 72.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.859 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.7 m -67.65 -42.38 82.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.939 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 26.2 t -73.44 -43.46 55.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . 0.418 ' O ' ' HG3' ' A' ' 438' ' ' ARG . 4.7 mtt180 -59.21 -40.64 86.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.752 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -69.4 -34.58 74.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.892 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.77 -45.34 61.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.634 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 435' ' ' ARG . 0.2 OUTLIER -66.33 -35.06 79.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.389 . . . . 0.0 110.602 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -34.25 77.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -67.33 -37.0 82.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.76 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -61.95 -45.53 93.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.058 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.538 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 31.5 t -63.32 -32.76 57.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.788 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -46.79 62.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.023 0.44 . . . . 0.0 110.815 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.73 88.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.046 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.538 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 1.9 pp -63.37 -31.15 51.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.99 0.424 . . . . 0.0 110.609 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.32 -47.7 84.89 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.837 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.74 -35.85 79.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 41.6 mt -70.16 -36.4 67.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.861 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -48.33 79.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.72 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -39.71 91.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.24 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -57.77 -30.1 65.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.166 0.508 . . . . 0.0 109.692 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.4 ' CG ' HD21 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -72.08 -37.28 69.64 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.378 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -58.07 -29.91 65.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.63 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -91.01 -15.07 30.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.485 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -24.41 34.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.884 0.373 . . . . 0.0 110.583 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.32 -86.58 0.35 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.262 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.774 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 112.462 -0.255 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.411 ' N ' ' HD2' ' A' ' 373' ' ' PRO . 2.4 t -178.6 -61.67 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.597 0.237 . . . . 0.0 110.94 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' A' ' 372' ' ' SER . 37.2 Cg_endo -65.75 109.81 1.53 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.396 2.064 . . . . 0.0 112.32 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -135.1 50.34 2.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.739 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 61.46 153.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.847 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.29 156.75 63.07 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.952 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.574 ' HG2' ' HB ' ' A' ' 380' ' ' ILE . 95.0 Cg_endo -80.81 167.78 18.17 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.794 2.329 . . . . 0.0 112.295 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -96.77 -9.74 0.79 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.197 2.598 . . . . 0.0 114.135 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.41 -28.33 3.96 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.574 ' HB ' ' HG2' ' A' ' 377' ' ' PRO . 24.8 mm -58.62 -29.38 39.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.422 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.55 -33.31 66.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.008 -179.715 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -68.24 -38.09 81.48 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.224 0.535 . . . . 0.0 110.65 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 47.7 mt -60.49 -33.97 56.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.531 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.78 -44.63 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.348 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -56.8 -48.44 77.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.323 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 13.5 p -66.41 -36.3 77.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.652 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.34 -35.93 80.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.43 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . 0.4 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 4.4 mt-10 -62.79 -34.95 78.33 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -34.65 72.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.54 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.4 t -70.4 -46.17 71.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.283 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 388' ' ' GLU . 14.5 pt20 -58.32 -38.8 77.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.683 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.78 -43.42 98.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.78 -38.55 82.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.47 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -39.88 83.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.602 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -45.39 92.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.637 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -69.29 -44.26 72.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.76 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . 0.403 ' CG1' HD12 ' A' ' 452' ' ' LEU . 28.0 t -60.61 -31.38 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.507 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -60.38 -36.37 77.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.206 0.527 . . . . 0.0 109.928 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.48 ' O ' ' O ' ' A' ' 400' ' ' PHE . 5.2 tt0 -90.73 -69.03 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.926 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.524 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 10.2 t80 36.47 109.0 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.118 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 27.8 m -94.81 25.44 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.107 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.524 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.07 -174.46 43.83 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.707 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.81 143.61 48.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.574 -0.313 . . . . 0.0 111.413 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.521 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -56.69 -23.71 44.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.549 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.68 10.15 36.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.308 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.47 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 0.1 OUTLIER -101.93 150.58 23.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.841 0.353 . . . . 0.0 110.474 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.778 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 pptp? -61.13 -30.2 70.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.85 -29.23 70.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.24 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.6 t80 -69.69 -45.6 67.91 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.778 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 5.5 p-90 -72.87 -30.53 64.05 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.902 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.599 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 26.0 tp -69.69 -38.43 77.01 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.418 177.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.467 HD22 ' CE2' ' A' ' 400' ' ' PHE . 9.7 tp -61.53 -47.19 86.72 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 2.0 mt-10 -70.5 -32.52 70.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.483 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.599 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mm-40 -65.51 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.001 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.67 -44.49 70.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.025 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 413' ' ' GLU . 4.3 pp -68.86 -37.05 78.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.782 0.325 . . . . 0.0 110.734 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 59.7 m -64.15 -38.97 92.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.621 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -47.28 86.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -68.53 -34.75 76.42 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.408 ' CD1' HD12 ' A' ' 445' ' ' ILE . 0.3 OUTLIER -60.79 -40.88 94.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.048 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.3 tp -69.4 -31.83 70.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.54 -38.32 87.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -31.23 68.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.792 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.83 27.8 5.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.5 t -100.11 -29.75 12.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 4.3 m -93.77 123.79 46.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 154.58 22.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.985 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 88.4 m -111.19 -64.39 1.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 108.89 -121.9 6.37 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.442 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -106.01 36.14 4.59 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.395 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -106.9 100.19 9.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.835 0.35 . . . . 0.0 110.921 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.14 -33.93 76.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 4.1 t -60.99 -44.83 96.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 28.9 t -70.31 -42.45 78.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.152 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -59.62 -40.69 88.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.827 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.31 -41.78 98.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.05 89.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.978 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.67 -44.51 81.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.759 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -67.95 -39.73 83.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.682 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -71.19 -36.57 71.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.781 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.73 -45.54 82.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.001 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.455 ' HA ' ' CD1' ' A' ' 445' ' ' ILE . 38.6 t -64.58 -33.05 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.024 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 9.4 m -60.89 -43.98 97.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.17 -36.31 83.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.332 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.455 ' CD1' ' HA ' ' A' ' 442' ' ' VAL . 30.0 mt -63.93 -31.23 52.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -42.54 83.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.145 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.83 78.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.726 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 45.2 mt -65.07 -36.46 77.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.712 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -54.3 48.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.867 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -42.12 88.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.393 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -29.96 65.37 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.403 HD12 ' CG1' ' A' ' 397' ' ' VAL . 0.1 OUTLIER -68.73 -38.24 80.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.289 179.152 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.77 -29.85 65.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.896 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.92 -23.57 25.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.221 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -20.06 37.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.775 0.321 . . . . 0.0 110.734 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -67.85 -86.73 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.026 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.894 179.852 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.4 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 0.3 OUTLIER -72.76 -60.64 1.88 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.698 0.285 . . . . 0.0 110.932 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . 0.4 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 59.8 Cg_endo -72.48 -179.81 4.42 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.554 2.169 . . . . 0.0 112.33 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -143.6 157.02 44.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.934 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -94.87 -173.66 3.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.967 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 69.16 136.5 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.925 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.448 ' HD2' HG13 ' A' ' 380' ' ' ILE . 44.1 Cg_exo -57.07 -176.48 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.537 2.158 . . . . 0.0 112.344 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.402 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 73.9 Cg_endo -86.99 -30.32 0.33 Allowed 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.807 2.338 . . . . 0.0 113.27 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.1 t -90.5 -25.26 20.36 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 120.588 0.232 . . . . 0.0 111.56 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.448 HG13 ' HD2' ' A' ' 377' ' ' PRO . 42.5 mm -58.72 -29.66 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.446 ' HA ' HG12 ' A' ' 384' ' ' ILE . 16.9 mttt -56.74 -33.12 66.24 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -66.41 -38.04 86.56 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.204 0.526 . . . . 0.0 110.694 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 54.5 mt -60.5 -34.76 59.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.398 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.96 -44.58 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.224 178.392 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -56.65 -37.39 70.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.398 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 68.5 t -73.52 -40.69 55.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.484 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.524 ' O ' HG12 ' A' ' 390' ' ' VAL . 1.2 tt -67.57 -37.54 82.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.327 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.94 -34.93 78.51 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -44.48 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.083 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.5 p -63.18 -41.19 91.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.426 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.42 ' N ' HG11 ' A' ' 390' ' ' VAL . 11.9 pt20 -63.28 -37.95 89.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.991 0.424 . . . . 0.0 110.433 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -72.47 -39.83 67.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.427 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.11 -42.48 99.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.89 92.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.713 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -62.21 -35.37 78.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.662 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.28 -42.43 75.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.826 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 14.5 t -60.66 -32.45 51.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.666 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -61.2 -36.16 79.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.96 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.503 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.9 tt0 -91.78 -68.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.993 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.458 ' CG ' HD22 ' A' ' 412' ' ' LEU . 6.6 t80 45.02 -84.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.714 -0.675 . . . . 0.0 112.611 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 399' ' ' GLU . 5.7 t 78.35 28.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.508 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -98.57 -150.76 26.35 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.501 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.63 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.44 171.09 14.54 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 120.439 0.162 . . . . 0.0 110.598 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -91.0 -10.17 43.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.58 0.228 . . . . 0.0 111.155 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 30.8 p -115.73 -15.55 11.32 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 18.2 t70 -61.54 162.37 8.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.887 0.375 . . . . 0.0 111.341 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.723 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.36 -38.42 71.57 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.627 179.671 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.69 -29.02 70.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.655 178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.63 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 60.4 t80 -57.5 -45.4 84.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.926 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.723 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.58 -29.44 63.53 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 118.865 -1.134 . . . . 0.0 108.663 178.15 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.553 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -65.16 -39.34 92.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.356 177.835 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.458 HD22 ' CG ' ' A' ' 400' ' ' PHE . 8.3 tp -61.42 -47.04 87.58 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 30.6 tt0 -70.49 -32.27 69.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.688 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -64.02 -39.8 94.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.137 -179.426 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 41.2 ttm -69.74 -44.68 69.77 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.292 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 413' ' ' GLU . 4.0 pp -68.75 -38.54 80.18 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.766 0.317 . . . . 0.0 110.683 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 84.8 m -64.32 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.194 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.477 ' O ' HD13 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -66.01 -42.36 89.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.294 179.509 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.59 -36.65 68.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.318 0.58 . . . . 0.0 110.038 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.2 OUTLIER -67.77 -49.26 63.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.833 -179.361 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . 0.481 ' CD1' ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -69.74 -31.53 69.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.138 -0.225 . . . . 0.0 111.355 -178.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . 0.481 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 0.3 OUTLIER -61.09 -46.55 90.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.842 0.353 . . . . 0.0 110.791 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.8 -31.0 68.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.061 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -82.41 0.5 41.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.414 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.11 -42.64 8.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 110.945 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.4 t -66.97 136.21 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.216 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -112.6 -178.45 3.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -138.68 160.92 38.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.854 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -126.96 43.34 1.35 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.481 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 136.77 -28.45 2.85 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -76.95 96.36 4.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.881 0.372 . . . . 0.0 110.905 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.21 -30.06 69.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.982 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -42.93 89.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.962 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 31.2 t -62.78 -35.63 71.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.031 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -65.54 -43.81 88.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.12 -32.88 72.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.144 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -68.61 -45.17 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.417 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 11.1 ptt85 -72.63 -44.53 61.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.127 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -63.01 -34.61 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.836 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.12 -39.71 65.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.79 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -71.01 -45.57 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.1 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 46.9 t -62.86 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.959 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 11.8 t -60.9 -35.55 76.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.68 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.55 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.402 HG12 ' CG2' ' A' ' 390' ' ' VAL . 1.1 mt -65.52 -31.24 52.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -43.95 97.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.127 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.41 86.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.608 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 43.9 mt -67.43 -36.39 76.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.842 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.3 tt -57.35 -47.48 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.888 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -41.35 98.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.804 0.335 . . . . 0.0 110.125 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -30.13 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -38.42 85.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.378 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.37 -29.89 62.01 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -89.7 -20.08 24.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.402 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -20.29 36.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.006 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.43 -81.55 0.45 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.469 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.955 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.186 0 N-CA-C 112.541 -0.224 . . . . 0.0 112.541 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.403 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 1.0 OUTLIER -63.74 -60.52 8.9 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.702 0.287 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . 0.403 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 58.0 Cg_endo -71.4 -167.93 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.43 2.087 . . . . 0.0 112.325 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -143.37 -42.53 0.29 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.148 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 66.65 85.59 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.981 0.419 . . . . 0.0 110.78 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.58 137.89 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.127 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.764 ' CG ' ' HB ' ' A' ' 380' ' ' ILE . 72.8 Cg_endo -71.94 -176.15 1.97 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.042 2.495 . . . . 0.0 112.571 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.486 ' CD ' ' HB2' ' A' ' 377' ' ' PRO . 41.0 Cg_endo -91.97 -74.75 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.003 2.469 . . . . 0.0 113.161 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 44.9 t -80.34 -24.16 40.07 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.764 ' HB ' ' CG ' ' A' ' 377' ' ' PRO . 1.6 mp -58.74 -28.82 38.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.471 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -55.78 -33.11 64.06 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.973 -179.055 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -37.99 85.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.211 0.529 . . . . 0.0 110.617 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . 0.413 HG21 HD13 ' A' ' 383' ' ' ILE . 39.4 mm -60.54 -34.42 58.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.577 178.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.78 -44.39 45.84 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.608 178.62 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -56.42 -42.55 78.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.836 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 38.4 t -70.85 -36.65 65.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.914 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -36.05 80.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.157 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -35.1 78.69 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -34.61 73.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.81 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 25.7 t -74.85 -35.82 37.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.312 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.37 -41.01 83.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.581 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.28 -41.81 76.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.05 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 -37.94 88.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.328 179.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -60.9 -41.15 95.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -39.79 88.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.37 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -68.76 -39.17 80.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.524 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 35.2 t -60.71 -34.46 58.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.605 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -59.02 -40.24 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.989 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.8 tt0 -86.7 -68.23 0.76 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.823 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.466 ' CG ' HD21 ' A' ' 412' ' ' LEU . 4.7 t80 52.42 -80.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.454 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . 0.496 ' N ' ' O ' ' A' ' 399' ' ' GLU . 17.3 t 74.32 29.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.32 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -101.86 -151.38 24.17 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.654 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.641 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.4 OUTLIER -133.46 171.13 14.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.559 0.219 . . . . 0.0 110.732 -179.853 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.473 ' HA ' ' CD1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -91.98 -8.89 44.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.072 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.81 -14.58 11.34 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.462 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 33.8 t70 -63.62 163.05 11.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.913 0.387 . . . . 0.0 111.405 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.729 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.2 OUTLIER -71.52 -38.09 71.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.349 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.69 -28.94 70.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.622 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.641 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 58.4 t80 -58.26 -45.51 87.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.051 -179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.729 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.64 -30.75 64.57 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 118.92 -1.112 . . . . 0.0 108.658 178.165 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 8.6 tp -64.73 -39.54 93.81 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.135 177.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.466 HD21 ' CG ' ' A' ' 400' ' ' PHE . 7.0 tp -60.48 -46.96 88.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -70.35 -32.2 69.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.9 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.6 -43.25 97.46 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.955 -179.249 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -69.44 -34.9 75.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.279 0.561 . . . . 0.0 110.1 179.143 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -60.42 -40.81 92.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.04 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.8 m -71.71 -32.46 67.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.006 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -47.11 84.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.539 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.58 -43.03 98.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.121 0.486 . . . . 0.0 109.703 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 2.8 tp -62.06 -43.59 98.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.14 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.78 -31.85 72.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.95 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -71.06 -37.14 72.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.79 -31.02 70.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.925 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.16 -8.17 55.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.54 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.8 t -53.44 -30.13 38.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.802 0.334 . . . . 0.0 111.169 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 12.1 m -70.79 131.18 34.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.103 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -85.58 -30.27 23.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.959 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 16.6 m 61.69 157.62 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.831 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -143.73 60.6 0.52 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.575 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 70.39 28.99 70.47 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.462 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -106.43 117.7 34.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.869 0.366 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.33 -31.44 70.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.85 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.0 t -60.31 -44.8 95.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.842 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 26.5 t -75.44 -40.88 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -61.66 -40.99 96.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -34.82 75.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.03 77.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.202 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -71.15 -41.12 70.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.933 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 13.4 ttpt -62.2 -31.53 72.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.762 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -72.24 -37.6 69.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.731 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -66.64 -45.58 78.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.096 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.544 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 20.1 t -71.73 -30.74 39.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 46.8 t -70.71 -46.72 62.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.977 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.11 -44.72 75.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.028 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.544 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.7 pp -63.35 -31.12 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.462 . . . . 0.0 110.771 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.41 -45.76 89.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.271 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.89 -34.19 74.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.536 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 17.1 mt -74.75 -36.48 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.723 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -53.87 53.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.861 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -61.46 -44.08 97.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.823 0.344 . . . . 0.0 110.342 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -29.75 65.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.416 ' CD1' HD22 ' A' ' 412' ' ' LEU . 0.5 OUTLIER -71.88 -40.04 69.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.803 179.479 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 454' ' ' LYS . 0.0 OUTLIER -64.28 -29.84 70.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.786 0.327 . . . . 0.0 110.841 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . 0.436 ' N ' ' HG3' ' A' ' 453' ' ' GLU . 0.3 OUTLIER -91.6 -13.96 31.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.301 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -82.51 -25.7 33.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.976 0.417 . . . . 0.0 110.465 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -72.66 -64.05 2.7 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.263 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.163 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.421 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 1.0 OUTLIER -178.72 -61.4 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.68 0.276 . . . . 0.0 110.876 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 60.3 Cg_endo -72.59 -28.83 13.87 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.484 2.123 . . . . 0.0 112.297 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -102.28 31.19 4.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -109.94 75.03 0.92 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.87 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.33 135.88 10.82 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.13 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.631 ' CG ' ' HB ' ' A' ' 380' ' ' ILE . 59.0 Cg_endo -70.17 175.25 8.69 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.783 2.322 . . . . 0.0 112.212 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.461 ' HD2' ' HB2' ' A' ' 377' ' ' PRO . 10.9 Cg_endo -54.85 -77.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.602 2.201 . . . . 0.0 113.495 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 379' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 382' ' ' LYS . 0.2 OUTLIER -102.37 -23.02 14.0 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -178.628 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.631 ' HB ' ' CG ' ' A' ' 377' ' ' PRO . 1.1 mm -58.74 -29.55 40.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.43 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.57 -33.22 65.95 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.631 -179.344 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 383' ' ' ILE . 0.1 OUTLIER -68.35 -37.63 80.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.077 0.465 . . . . 0.0 110.732 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . 0.518 ' N ' ' HG3' ' A' ' 382' ' ' LYS . 16.2 mt -60.97 -34.06 58.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.482 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.439 ' N ' HD12 ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.97 -44.64 44.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.225 178.526 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -56.49 -47.57 78.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.334 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.2 p -66.46 -37.38 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.189 179.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.57 -34.24 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.142 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 12.1 mt-10 -62.74 -34.83 78.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.57 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -70.27 -34.7 73.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.451 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.87 -46.35 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.353 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 394' ' ' GLU . 14.5 pt20 -58.46 -37.49 75.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.696 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.408 ' O ' ' CG ' ' A' ' 395' ' ' GLN . 19.1 t80 -72.34 -35.1 68.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.205 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.35 -37.84 74.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.728 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 395' ' ' GLN . 0.0 OUTLIER -64.87 -38.88 92.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . 0.431 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 12.0 pt20 -69.77 -31.65 69.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.849 0.357 . . . . 0.0 110.467 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -68.73 -39.37 80.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.653 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 42.6 t -60.74 -47.29 93.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.593 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -56.69 -38.69 72.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.462 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -74.28 -58.09 3.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.38 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.567 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 0.1 OUTLIER -56.86 125.15 21.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.367 0.603 . . . . 0.0 110.456 179.729 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . 0.453 ' O ' ' O ' ' A' ' 402' ' ' GLY . 13.7 p -116.53 43.9 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.512 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.567 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.8 -164.3 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.841 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.83 143.79 48.57 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.789 0.328 . . . . 0.0 111.632 -179.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.486 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 7.9 mttt -61.53 -21.13 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.941 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 23.7 m -94.22 8.67 40.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.85 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.409 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t70 -115.07 161.78 17.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.976 0.417 . . . . 0.0 111.027 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.721 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.59 -30.0 65.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.3 179.438 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.81 -29.41 70.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.1 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.486 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 6.1 t80 -73.72 -46.13 47.89 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.296 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.721 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.3 p-90 -73.08 -29.01 62.64 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 118.853 -1.139 . . . . 0.0 108.78 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.604 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.6 tp -67.35 -39.81 85.77 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.886 177.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.469 HD23 ' CD1' ' A' ' 400' ' ' PHE . 2.6 tp -59.67 -46.91 87.63 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 1.6 tt0 -69.85 -31.68 69.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.421 177.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.604 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 2.4 mm-40 -63.48 -38.67 92.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.271 -179.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.52 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 1.9 mmt -69.72 -44.64 69.89 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.749 0.309 . . . . 0.0 111.004 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 413' ' ' GLU . 4.4 pp -69.0 -37.17 78.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.578 -179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 417' ' ' THR . . . . . 0.415 ' N ' ' CD1' ' A' ' 416' ' ' LEU . 1.0 OUTLIER -68.38 -43.75 76.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.733 0.302 . . . . 0.0 111.152 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -57.98 -47.22 83.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.382 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -65.9 -34.94 79.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.415 ' HB2' ' CD1' ' A' ' 445' ' ' ILE . 0.2 OUTLIER -67.05 -39.05 86.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.1 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.32 -31.8 69.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.918 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.01 -44.42 76.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.921 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.01 -35.86 77.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.878 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -79.35 -20.89 46.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 16.7 t -54.02 -30.91 49.53 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.89 0.376 . . . . 0.0 111.036 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.7 t -79.65 116.08 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.961 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.23 -34.01 61.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.32 131.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.127 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.98 -89.2 1.79 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.372 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -107.86 64.63 0.26 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.335 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -139.56 87.5 2.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.851 0.358 . . . . 0.0 110.899 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -40.95 95.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.975 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 2.9 t -59.11 -43.28 91.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.011 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 34.3 t -69.11 -35.53 68.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -44.47 78.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -69.31 -33.0 72.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.998 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.51 -44.73 67.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.433 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -69.52 -40.66 76.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.214 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -44.9 82.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.891 0.377 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -69.82 -39.44 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.524 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.136 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.449 ' O ' ' CG ' ' A' ' 446' ' ' GLN . 41.0 t -62.94 -45.6 98.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.072 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . 0.608 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.6 m -60.38 -30.35 69.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.725 0.297 . . . . 0.0 110.213 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . 0.43 ' O ' HG13 ' A' ' 448' ' ' ILE . 37.9 tttp -63.94 -43.14 96.73 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.415 ' CD1' ' HB2' ' A' ' 420' ' ' LEU . 0.9 OUTLIER -73.62 -34.85 42.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.935 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . 0.608 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.3 OUTLIER -60.7 -48.02 83.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.709 178.871 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -55.85 -42.7 76.21 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.72 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 444' ' ' LYS . 11.3 mt -64.52 -36.33 77.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.837 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.13 -44.66 83.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.894 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 -44.07 64.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 0.0 110.193 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 31.1 mtmm -57.86 -29.94 65.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.17 0.509 . . . . 0.0 109.666 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.413 ' CD1' HD21 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -73.73 -36.71 65.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.441 179.304 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -29.98 67.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -93.68 -19.34 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm -82.55 -20.81 35.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.735 0.303 . . . . 0.0 110.919 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.402 ' HA3' ' CD2' ' A' ' 409' ' ' TYR . . . -82.12 -101.37 0.43 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.43 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.278 -0.868 . . . . 0.0 110.945 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.112 0 N-CA-C 112.524 -0.23 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 19.5 m -115.52 86.06 14.59 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.713 0.292 . . . . 0.0 110.872 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.14 -170.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.588 2.192 . . . . 0.0 112.319 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -64.2 -18.13 64.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.263 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 62.7 122.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.84 0.352 . . . . 0.0 111.013 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.02 129.13 9.59 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.863 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.464 ' HD2' HG13 ' A' ' 380' ' ' ILE . 59.5 Cg_exo -52.57 -179.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.584 2.189 . . . . 0.0 112.322 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -80.1 -37.06 0.46 Allowed 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 123.122 2.548 . . . . 0.0 113.105 -179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.03 -23.37 23.8 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.464 HG13 ' HD2' ' A' ' 377' ' ' PRO . 31.2 mm -58.65 -29.75 40.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.452 ' HA ' HG12 ' A' ' 384' ' ' ILE . 11.5 mttt -56.77 -33.17 66.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.047 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 4.2 pttm -68.27 -38.0 81.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.164 0.507 . . . . 0.0 110.517 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 43.6 mm -60.5 -33.37 54.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.521 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.452 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.84 -44.73 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.209 178.495 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -57.0 -49.38 75.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.48 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 40.9 t -64.15 -36.13 75.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.41 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.46 -34.54 77.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.375 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . 0.432 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.0 tt0 -62.77 -35.0 78.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.622 179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -70.41 -34.57 72.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.728 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 25.8 t -65.35 -46.91 89.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 4.6 pt20 -63.15 -37.76 88.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.84 0.352 . . . . 0.0 110.708 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.22 -36.87 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.09 179.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 3.5 mt -65.91 -37.77 86.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.296 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -58.7 -44.53 90.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.561 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -41.35 89.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.461 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -69.2 -39.92 78.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.013 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.62 -30.66 47.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.803 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -66.83 -33.13 74.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.415 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' A' ' 400' ' ' PHE . 16.5 tt0 -89.43 -55.41 3.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.533 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.549 ' CE2' ' HA3' ' A' ' 402' ' ' GLY . 13.8 t80 -20.35 120.27 0.03 OUTLIER 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 11.6 p -100.5 29.43 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.625 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.549 ' HA3' ' CE2' ' A' ' 400' ' ' PHE . . . -41.9 162.8 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.527 -0.761 . . . . 0.0 113.777 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 1.4 mppt? -133.56 143.67 48.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.151 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -17.46 53.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.703 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.4 m -108.4 -15.54 14.43 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.503 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 14.2 t70 -76.24 135.25 39.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.925 0.393 . . . . 0.0 110.743 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.726 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 mptp? -61.13 -30.82 70.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.214 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 412' ' ' LEU . . . -65.41 -29.13 69.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.409 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 0.2 OUTLIER -68.95 -45.59 70.34 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.539 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.726 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 15.7 p-90 -72.86 -30.13 63.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.069 -1.053 . . . . 0.0 108.886 178.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.592 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 25.9 tp -69.76 -38.56 76.81 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.327 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.501 ' CD2' ' CD2' ' A' ' 400' ' ' PHE . 0.4 OUTLIER -62.09 -47.26 85.42 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.147 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 -32.28 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.302 177.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.592 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.77 -36.42 83.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.532 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 10.9 ttt -69.57 -41.05 76.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.004 0.431 . . . . 0.0 110.171 179.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 3.9 mt -62.43 -46.92 86.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.639 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 7.6 m -65.8 -30.44 71.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.767 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -47.31 86.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.159 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.584 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.49 -38.85 81.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.472 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.3 mp -66.56 -31.98 73.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.668 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -45.07 86.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.748 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 5.5 mt -57.69 -32.57 67.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.007 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -79.88 -31.84 40.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 10.0 t -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.5 t -80.56 119.64 30.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -70.39 131.66 44.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.933 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 19.0 p -108.48 -36.91 6.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.888 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 90.39 -91.96 1.73 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.488 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -152.54 47.78 0.55 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.5 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.01 115.64 28.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 0.0 110.797 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -42.97 80.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 25.6 t -64.2 -44.86 90.66 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.923 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 37.8 t -69.55 -40.76 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -44.35 91.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.926 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -38.35 78.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -66.64 -45.13 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.273 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -68.11 -39.37 82.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.956 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -66.25 -34.44 78.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -71.39 -39.34 71.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.88 97.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.158 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.85 -39.64 85.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.996 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -36.63 79.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.492 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -34.69 78.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.572 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . . . . . . . . . 3.1 mm -66.78 -31.19 52.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.14 0.495 . . . . 0.0 110.751 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -45.99 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.663 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.47 -38.46 87.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.039 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 16.3 mt -74.83 -36.57 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.51 -43.56 84.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.938 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.77 62.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.629 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -57.84 -32.67 67.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 109.808 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.64 -36.6 51.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.402 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.17 -30.0 61.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.553 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -91.95 -12.4 33.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.176 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -82.16 -26.4 33.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.125 0.488 . . . . 0.0 110.828 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -82.97 -96.32 0.55 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.375 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.008 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 112.555 -0.218 . . . . 0.0 112.555 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 1.7 m -155.3 58.01 1.79 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.333 . . . . 0.0 110.889 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.54 -169.83 0.34 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.56 2.173 . . . . 0.0 112.285 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 60.5 100.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.948 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -164.78 147.8 8.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.946 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 5.1 p -63.97 109.61 2.88 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.845 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.456 ' HD2' HG13 ' A' ' 380' ' ' ILE . 17.8 Cg_exo -67.29 153.52 76.85 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.671 2.247 . . . . 0.0 111.964 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.46 -14.66 30.9 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.458 2.105 . . . . 0.0 113.146 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 81.3 p -96.68 -26.1 15.31 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.694 0.283 . . . . 0.0 111.461 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.456 HG13 ' HD2' ' A' ' 377' ' ' PRO . 28.9 mm -58.6 -29.65 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.439 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -33.2 66.35 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.849 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -67.25 -38.02 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.091 0.472 . . . . 0.0 110.836 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 34.3 mt -60.52 -34.54 58.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.376 178.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.439 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.94 -44.67 44.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.318 178.444 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -57.02 -49.35 76.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.411 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.52 -37.78 80.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.483 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.499 ' O ' HG11 ' A' ' 390' ' ' VAL . 4.3 tt -67.57 -32.96 74.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.82 -35.21 79.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.48 66.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.147 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.499 HG11 ' O ' ' A' ' 387' ' ' LEU . 2.4 p -63.5 -39.09 84.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.479 -179.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.16 -34.52 77.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.901 0.381 . . . . 0.0 110.627 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.99 -43.46 95.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.579 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -37.91 82.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.596 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -58.79 -44.05 90.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.485 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.62 -31.65 72.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.509 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -68.42 -44.17 75.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . 0.402 ' CG1' ' HG ' ' A' ' 452' ' ' LEU . 19.7 t -60.68 -38.05 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.821 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -59.49 -32.58 70.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.522 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -78.63 -57.35 3.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.555 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.541 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 0.3 OUTLIER -60.34 127.7 33.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.288 0.566 . . . . 0.0 110.53 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 22.1 t -123.11 39.86 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.401 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.541 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -53.76 -166.13 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.678 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.485 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.96 149.19 51.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 0.0 111.853 -179.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.479 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 2.0 mmmt -58.78 -25.09 62.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.081 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 70.9 p -85.94 3.7 40.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.448 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.485 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 26.4 t70 -111.96 156.68 21.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.111 0.482 . . . . 0.0 111.432 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.738 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.4 mttp -69.31 -29.97 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.039 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.87 -29.42 70.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.328 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.479 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 33.1 t80 -69.2 -45.53 69.65 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.969 -179.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.738 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.3 OUTLIER -72.63 -32.66 66.07 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 118.628 -1.229 . . . . 0.0 108.539 178.162 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 17.8 tp -63.57 -38.35 90.79 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.477 ' HG ' ' CE1' ' A' ' 400' ' ' PHE . 0.4 OUTLIER -59.71 -47.15 86.8 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.465 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -70.38 -31.78 69.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.893 177.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.32 -40.17 96.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.222 -178.581 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.464 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.62 -44.2 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.222 0.534 . . . . 0.0 109.909 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 7.0 tp -66.36 -41.0 90.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.78 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 417' ' ' THR . . . . . 0.417 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 94.9 m -62.69 -30.36 71.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -71.01 -44.65 65.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.596 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -64.23 -44.64 91.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.625 0.25 . . . . 0.0 111.41 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.417 ' CD2' ' HA ' ' A' ' 417' ' ' THR . 1.4 pp -66.27 -35.34 80.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.893 0.378 . . . . 0.0 110.511 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . 0.407 ' CD1' ' CD1' ' A' ' 420' ' ' LEU . 3.9 mp -70.31 -31.87 69.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.446 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.53 -46.28 90.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 1.8 mp -66.12 -31.01 71.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.719 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -58.37 -26.5 63.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.01 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.05 38.35 1.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.863 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 14.2 p -91.19 130.02 41.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.64 -70.13 0.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.984 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 27.5 m 67.25 -69.5 0.13 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.028 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 98.37 -60.58 0.92 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 177.76 38.39 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.421 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -93.43 120.08 33.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.818 0.342 . . . . 0.0 110.926 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -31.07 69.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 21.5 t -65.42 -42.03 92.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.932 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 39.9 t -68.29 -37.45 77.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.92 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.755 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.16 -34.37 74.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.924 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.04 -45.16 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -44.24 83.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.972 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -60.46 -39.45 87.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -69.76 -31.71 69.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.727 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . 0.427 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -69.4 -45.66 68.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.11 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.496 ' HA ' ' CD1' ' A' ' 445' ' ' ILE . 25.6 t -64.25 -34.3 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.866 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -45.09 95.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.215 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -37.2 86.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.083 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.496 ' CD1' ' HA ' ' A' ' 442' ' ' VAL . 24.2 mt -64.36 -32.73 58.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.704 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.58 -47.59 83.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.011 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.84 -42.45 93.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.17 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 34.2 mt -63.6 -36.56 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.803 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.3 tp -57.58 -47.59 81.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.817 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -34.53 68.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -57.87 -33.2 68.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.987 0.422 . . . . 0.0 110.313 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.402 ' HG ' ' CG1' ' A' ' 397' ' ' VAL . 1.8 mt -77.66 -36.79 51.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.434 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.92 -29.87 63.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.791 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -22.2 17.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.059 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -82.43 -19.88 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.958 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -86.32 -103.51 0.76 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.418 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.963 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.419 -0.272 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 7.5 t -151.38 131.39 6.97 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.541 0.21 . . . . 0.0 110.845 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.75 107.86 0.24 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.37 2.047 . . . . 0.0 112.305 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.05 119.33 6.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.87 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.77 -60.6 0.37 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.83 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 376' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 1.4 m -115.11 134.77 22.48 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.805 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.413 ' HD2' ' CD1' ' A' ' 380' ' ' ILE . 37.3 Cg_exo -60.93 177.79 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.474 2.116 . . . . 0.0 112.131 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -89.88 2.09 5.41 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.815 2.343 . . . . 0.0 113.199 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.03 -23.67 6.28 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.413 ' CD1' ' HD2' ' A' ' 377' ' ' PRO . 6.0 mt -58.85 -29.91 41.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.564 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.431 ' HA ' HG12 ' A' ' 384' ' ' ILE . 1.3 mttt -56.96 -33.15 66.76 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.868 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -66.69 -38.04 85.98 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 110.928 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 33.7 mm -60.52 -35.59 64.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.293 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.431 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.91 -44.55 44.9 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.387 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.516 178.383 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -49.25 75.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.782 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.77 -33.65 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.672 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.25 -37.84 84.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.558 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . 0.405 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 10.3 mt-10 -62.6 -34.64 77.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.744 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -67.58 -34.66 77.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.477 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 32.4 t -66.21 -46.69 86.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.2 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 11.7 pt20 -62.89 -40.47 97.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.863 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.403 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 0.2 OUTLIER -68.92 -44.18 73.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.855 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -58.57 -40.26 82.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.764 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -59.8 -46.61 88.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.018 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.5 -36.14 75.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.14 -41.73 76.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.388 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 19.7 t -60.57 -45.75 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.328 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -24.12 31.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.006 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -95.77 -55.72 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.559 ' CZ ' ' CA ' ' A' ' 402' ' ' GLY . 0.0 OUTLIER -51.85 -27.08 11.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 -179.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 21.1 t 66.4 -44.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.627 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.559 ' CA ' ' CZ ' ' A' ' 400' ' ' PHE . . . 68.22 158.22 1.18 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.013 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.534 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.3 143.6 49.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.601 179.372 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -67.68 -15.05 63.45 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.6 t -115.54 8.96 15.28 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.441 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 35.9 t0 -100.67 136.6 40.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.833 0.349 . . . . 0.0 110.8 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.748 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.31 -31.8 71.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.887 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.97 -29.03 70.5 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.712 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.534 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -65.9 -45.31 82.42 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.748 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.9 p-90 -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.177 178.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.573 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 18.0 tp -69.65 -38.89 77.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.642 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.51 ' CD2' ' CE1' ' A' ' 400' ' ' PHE . 0.3 OUTLIER -62.55 -46.99 85.86 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.141 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.472 ' HA ' ' CD2' ' A' ' 416' ' ' LEU . 21.5 mt-10 -70.32 -32.42 70.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.429 177.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.573 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 4.5 mt-10 -66.38 -44.6 82.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.9 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.421 ' HG2' ' O ' ' A' ' 412' ' ' LEU . 8.3 ptm -65.71 -42.43 91.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.679 0.276 . . . . 0.0 111.312 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.472 ' CD2' ' HA ' ' A' ' 413' ' ' GLU . 3.1 pp -67.24 -36.69 82.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.907 0.384 . . . . 0.0 110.663 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 417' ' ' THR . . . . . 0.427 ' N ' HD13 ' A' ' 416' ' ' LEU . 0.7 OUTLIER -62.79 -33.89 76.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.737 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.475 ' O ' HD13 ' A' ' 421' ' ' LEU . 7.8 mttt -73.06 -34.15 66.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.052 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.469 ' HG2' ' HA ' ' A' ' 416' ' ' LEU . 7.7 pt-20 -72.83 -38.31 67.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 419' ' ' GLU . 4.3 pp -70.5 -43.71 69.13 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . 0.484 ' CD1' ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.56 -31.45 68.48 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.163 -179.288 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . 0.484 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 0.1 OUTLIER -64.35 -46.72 82.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.82 0.343 . . . . 0.0 111.47 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 1.9 pp -68.02 -30.94 70.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.167 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 -3.83 41.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.525 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.2 m -86.16 -5.03 59.28 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.553 0.216 . . . . 0.0 111.56 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.68 137.82 24.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.864 0.364 . . . . 0.0 111.066 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -73.06 156.49 38.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.887 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 69.1 p -137.24 110.68 7.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.907 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -82.43 -37.0 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.439 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 172.81 49.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.486 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -126.73 111.33 14.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.772 0.32 . . . . 0.0 110.93 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -67.1 -32.45 73.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.929 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -40.94 96.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 25.8 t -71.57 -39.82 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.093 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -44.67 90.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.745 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.53 -43.17 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.161 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.18 91.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.754 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 10.1 ptt85 -70.31 -40.42 74.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.68 0.276 . . . . 0.0 111.042 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.84 -32.91 74.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.07 -41.98 63.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.03 -45.57 92.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.21 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 46.2 t -69.55 -38.83 77.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.712 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.36 -39.21 93.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.873 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -63.19 -40.72 98.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.515 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.421 ' CD1' ' HB3' ' A' ' 420' ' ' LEU . 0.5 OUTLIER -63.81 -31.18 52.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.798 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -41.04 97.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.879 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.62 -37.27 83.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.237 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 31.7 mt -67.3 -36.4 76.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.58 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.8 mt -57.29 -46.99 82.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.751 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.5 -46.13 89.83 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -58.43 -30.02 66.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.241 0.543 . . . . 0.0 109.614 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.29 -36.77 53.89 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.335 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -61.73 -31.8 71.99 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.38 -19.35 20.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.971 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.9 mtmt -82.45 -23.37 34.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.353 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 402' ' ' GLY . . . -72.32 -93.13 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.6 mp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.217 179.796 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.419 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 0.0 OUTLIER -178.6 -61.82 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.652 0.263 . . . . 0.0 110.892 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . 0.419 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 58.6 Cg_endo -71.51 -27.48 18.84 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.456 2.104 . . . . 0.0 112.376 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -128.45 -177.03 4.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.876 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -95.7 -69.51 0.75 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.059 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 3.2 m 57.63 105.03 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.868 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.527 ' HG2' HG13 ' A' ' 380' ' ' ILE . 72.5 Cg_exo -52.26 -176.2 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.499 2.133 . . . . 0.0 112.638 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 10.1 Cg_exo -72.19 -68.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.036 2.491 . . . . 0.0 113.625 -178.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 63.7 m -70.34 -20.67 62.97 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 -178.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.527 HG13 ' HG2' ' A' ' 377' ' ' PRO . 34.1 mm -58.68 -30.11 41.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 7.5 mmtt -59.0 -33.32 70.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.884 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 7.5 mtpp -68.19 -38.12 81.66 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.17 0.509 . . . . 0.0 110.879 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 37.9 mm -60.45 -34.55 58.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.411 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.437 HD11 ' N ' ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.95 -44.72 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.414 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -47.19 80.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.009 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 47.5 t -70.39 -42.85 78.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.124 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.08 -38.88 92.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.771 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -62.75 -34.71 77.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -40.9 96.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.389 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.427 ' CG1' ' CD1' ' A' ' 445' ' ' ILE . 56.2 t -61.42 -37.94 78.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.591 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -41.13 93.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.71 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -72.53 -44.54 62.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.642 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -59.01 -42.48 90.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.755 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.28 -44.33 95.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -35.86 77.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.015 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -45.02 71.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . 0.41 ' CG2' ' CG2' ' A' ' 448' ' ' ILE . 17.1 t -60.58 -39.6 81.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.975 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -58.52 -38.91 78.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.012 0.434 . . . . 0.0 110.333 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -80.67 -54.45 5.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.349 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.6 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 42.8 t80 -21.4 116.86 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.401 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 25.5 m -111.21 27.03 2.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.192 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.6 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -54.72 -172.82 0.08 OUTLIER Glycine 0 N--CA 1.442 -0.962 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.326 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.515 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.89 143.86 48.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.781 -0.71 . . . . 0.0 111.236 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.25 -27.38 14.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.525 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.32 11.32 29.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.599 -179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -93.17 142.67 27.04 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.768 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.19 -30.29 70.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.983 0.42 . . . . 0.0 110.665 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -68.0 -29.16 68.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.836 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.515 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -66.52 -45.29 79.99 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.768 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 9.3 p-90 -72.67 -30.58 64.39 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 119.045 -1.062 . . . . 0.0 109.13 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.8 tp -69.79 -38.49 76.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.303 177.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.469 ' HG ' ' CD2' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -63.03 -47.07 84.63 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.092 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.447 ' HA ' ' CD2' ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.33 -32.04 69.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.372 177.86 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.586 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.87 -41.46 97.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.49 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 18.5 ptp -69.58 -44.54 70.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.637 0.256 . . . . 0.0 111.448 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.447 ' CD2' ' HA ' ' A' ' 413' ' ' GLU . 4.3 pp -66.48 -37.1 84.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.884 0.373 . . . . 0.0 110.231 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 417' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 420' ' ' LEU . 99.2 m -62.85 -30.39 71.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.208 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.471 ' O ' HD11 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -72.24 -32.65 66.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.913 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -72.72 -46.38 53.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.307 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.409 ' HB3' ' CB ' ' A' ' 445' ' ' ILE . 2.5 pp -62.96 -46.21 88.79 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.21 -178.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . 0.493 ' CD1' ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -68.2 -31.44 70.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 110.817 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . 0.493 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 1.3 tm-20 -58.33 -46.44 86.19 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.842 0.353 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -33.56 73.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.75 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -68.06 -28.3 67.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.962 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.5 p -96.57 38.53 1.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 10.2 p -86.14 137.78 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.85 110.03 16.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.04 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.3 t -156.02 121.7 4.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.16 -49.25 2.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.476 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -136.32 62.96 0.59 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.498 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -139.27 84.94 2.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.823 0.344 . . . . 0.0 110.922 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.56 -31.89 69.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -42.32 99.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 30.8 t -66.33 -45.6 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.068 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.78 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -68.14 -47.21 68.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.884 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.1 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.008 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -67.61 -36.64 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -66.94 -44.77 79.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.722 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.91 -34.7 76.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -70.32 -45.02 67.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.041 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 24.9 t -62.92 -45.91 97.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.99 -34.11 74.29 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.526 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.06 -36.4 83.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.944 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.427 ' CD1' ' CG1' ' A' ' 390' ' ' VAL . 1.7 mm -68.42 -31.31 50.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.292 179.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.63 -47.69 83.52 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.762 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.68 -35.36 80.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.425 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . 0.41 ' CG2' ' CG2' ' A' ' 397' ' ' VAL . 10.3 mt -74.58 -36.44 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.772 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.4 -55.4 35.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.687 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.07 -37.92 81.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.24 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 7.0 mtmm -57.86 -31.6 66.84 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.403 HD21 ' CG ' ' A' ' 412' ' ' LEU . 1.5 tm? -68.38 -38.95 81.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.393 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -60.81 -30.0 69.8 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.23 -15.74 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.131 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -22.65 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 110.837 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.68 -100.61 0.71 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.993 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.4 m -93.94 147.75 34.04 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 120.677 0.275 . . . . 0.0 110.894 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.35 90.64 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.549 2.166 . . . . 0.0 112.294 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -137.92 -43.54 0.52 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.001 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 63.61 137.94 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 376' ' ' THR . . . . . 0.434 ' O ' ' CD ' ' A' ' 381' ' ' LYS . 13.3 p -152.02 73.55 7.79 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.362 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.586 ' CB ' ' HD3' ' A' ' 378' ' ' PRO . 5.3 Cg_exo -76.85 -63.91 0.03 OUTLIER 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 122.423 2.082 . . . . 0.0 114.611 -178.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.586 ' HD3' ' CB ' ' A' ' 377' ' ' PRO . 50.4 Cg_endo -102.76 -109.58 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 122.351 2.034 . . . . 0.0 114.414 -177.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.87 -19.95 7.71 Favored 'General case' 0 CA--C 1.519 -0.231 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.416 ' CG2' HG22 ' A' ' 376' ' ' THR . 32.8 mm -58.71 -29.84 40.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 378' ' ' PRO . 0.0 OUTLIER -56.75 -37.28 70.82 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.16 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -64.59 -38.19 90.16 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.028 0.442 . . . . 0.0 111.185 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 16.6 mt -61.19 -35.24 64.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.328 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.419 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -75.05 -44.78 43.83 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.332 178.463 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -56.69 -49.41 75.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.918 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.69 -42.93 93.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.859 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.483 ' O ' HG11 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.57 -32.65 73.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.784 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -35.18 79.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -44.43 68.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.62 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.483 HG11 ' O ' ' A' ' 387' ' ' LEU . 1.6 p -66.45 -35.91 76.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.634 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.16 -40.66 90.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.533 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -35.07 68.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.83 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.87 -43.57 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.121 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 395' ' ' GLN . 0.1 OUTLIER -68.07 -33.28 74.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.777 0.323 . . . . 0.0 110.788 179.933 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . 0.43 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 1.8 tt0 -66.44 -35.59 80.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -69.1 -37.56 78.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.812 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 16.2 t -60.61 -40.49 84.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -55.86 -32.98 64.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.053 0.454 . . . . 0.0 110.301 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.43 ' O ' ' C ' ' A' ' 400' ' ' PHE . 30.6 tt0 -88.91 -54.34 4.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.296 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.623 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 35.1 t80 -20.84 124.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.131 -0.94 . . . . 0.0 113.299 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.0 p -120.9 24.77 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.392 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.623 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -59.61 -171.11 0.45 Allowed Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.949 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.83 143.45 48.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.288 -0.456 . . . . 0.0 111.354 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.448 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -53.1 -26.96 18.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.225 179.41 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.88 14.6 30.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.19 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -106.64 147.81 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.886 0.374 . . . . 0.0 110.957 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.776 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 2.3 ttpt -61.17 -30.33 70.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.691 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -66.09 -29.24 69.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.144 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 52.5 t80 -70.88 -45.94 63.49 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.776 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -72.97 -30.56 63.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 118.612 -1.235 . . . . 0.0 108.568 177.716 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 39.1 tp -66.41 -40.03 89.34 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.016 177.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.466 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.79 -47.04 87.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.613 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.45 ' HA ' ' CD2' ' A' ' 416' ' ' LEU . 29.8 mt-10 -70.32 -31.99 69.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.779 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.602 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.52 -41.41 98.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.712 -178.902 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.44 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 6.5 mmm -69.53 -44.67 70.49 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.906 0.384 . . . . 0.0 110.936 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.533 ' O ' ' HG3' ' A' ' 419' ' ' GLU . 4.4 pp -68.59 -36.83 79.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.158 179.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 417' ' ' THR . . . . . 0.402 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 95.4 m -72.03 -30.32 65.07 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.595 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -62.58 -47.45 83.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.572 -179.651 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' A' ' 416' ' ' LEU . 1.2 pp20? -65.3 -46.44 80.35 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.402 ' CD2' ' HA ' ' A' ' 417' ' ' THR . 0.3 OUTLIER -60.55 -34.51 74.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.102 0.477 . . . . 0.0 109.877 179.303 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.35 -31.77 69.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.179 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.23 -46.41 85.95 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.376 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 1.3 mt -70.29 -45.74 65.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.614 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 40.88 37.36 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.745 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.0 t 59.75 55.09 4.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 3.6 m -66.38 117.65 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.056 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.32 149.91 27.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.052 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 72.4 p -110.86 -27.14 8.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.994 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 106.81 -27.19 17.14 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.354 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 168.42 41.27 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.27 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.46 96.86 5.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 0.0 110.958 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.86 -31.79 72.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.815 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.28 -43.85 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.835 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 38.8 t -68.08 -37.99 79.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -40.76 87.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -66.14 -38.3 87.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.787 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.68 -38.73 73.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.027 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -62.13 -44.43 96.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.81 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -66.48 -37.05 84.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.81 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.47 -39.6 88.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.917 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.47 69.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.078 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 31.8 t -62.88 -44.98 99.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.84 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.5 m -60.85 -34.91 75.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.236 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -63.16 -34.62 78.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . . . . . . . . . 3.4 mm -66.35 -36.63 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-O 121.249 0.547 . . . . 0.0 110.531 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.92 -47.72 84.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.187 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.79 87.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.082 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 15.7 mt -73.52 -36.54 48.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.84 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.39 -46.67 83.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.905 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -38.33 70.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.524 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.85 -30.07 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.118 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.1 mt -77.58 -36.62 51.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.594 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -29.96 60.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.857 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -96.6 -12.35 24.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.332 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.53 -24.02 34.29 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.746 0.308 . . . . 0.0 110.846 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.428 ' HA2' ' HA ' ' A' ' 403' ' ' LYS . . . -92.42 -76.19 1.32 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.632 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 60.67 88.27 0.12 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.723 0.297 . . . . 0.0 110.945 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -51.67 157.13 5.66 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.534 2.156 . . . . 0.0 112.27 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -107.05 179.67 4.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.948 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -158.05 31.72 0.25 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.9 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 376' ' ' THR . . . . . 0.407 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 2.8 m 63.17 143.1 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.888 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.421 ' HD2' HG13 ' A' ' 380' ' ' ILE . 17.4 Cg_exo -67.69 149.01 78.81 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.576 2.184 . . . . 0.0 111.982 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 377' ' ' PRO . 14.2 Cg_exo -69.03 -8.9 24.88 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.609 2.206 . . . . 0.0 113.004 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 93.6 p -103.26 -25.45 13.33 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.724 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.421 HG13 ' HD2' ' A' ' 377' ' ' PRO . 27.7 mm -58.76 -29.82 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.426 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.36 -33.25 67.59 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.983 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -68.23 -38.1 81.5 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.174 0.512 . . . . 0.0 110.782 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.5 -34.14 57.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.433 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.43 HD11 ' N ' ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.94 -44.8 44.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.469 178.649 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -58.57 -49.4 77.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.084 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 46.8 t -68.31 -46.17 81.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.156 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.846 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.77 -34.88 78.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.21 0.529 . . . . 0.0 109.834 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -38.96 81.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.506 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 24.3 t -67.3 -36.0 75.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.741 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -41.11 96.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.664 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.82 -45.6 67.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.544 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -38.0 83.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.59 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -60.68 -42.03 96.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.698 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -58.06 -44.82 87.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.827 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.25 -45.25 70.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.775 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 58.2 t -60.64 -32.55 51.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.706 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.12 -34.72 76.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.044 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' O ' ' A' ' 400' ' ' PHE . 6.6 tt0 -91.43 -68.62 0.78 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.17 179.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.567 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 4.7 t80 54.55 157.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.591 0.71 . . . . 0.0 111.888 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 5.0 m -141.12 20.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.853 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.567 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -104.08 -170.46 25.12 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.889 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.421 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -134.14 143.93 48.24 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.58 -0.31 . . . . 0.0 111.68 -179.545 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.485 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 3.2 tttt -51.13 -28.77 11.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.138 179.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.74 14.34 32.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.391 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.19 164.97 11.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.799 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.41 -30.8 66.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.14 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.02 -29.14 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.027 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.485 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 18.5 t80 -69.38 -45.43 69.34 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.799 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.75 64.34 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.903 178.18 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.55 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -68.1 -39.33 82.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.454 177.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.471 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 10.0 tp -61.28 -46.85 88.64 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.33 -31.9 69.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.657 177.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.571 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 0.4 OUTLIER -63.38 -44.6 94.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.959 -179.166 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 6.3 ptp -66.29 -36.9 84.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.071 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 8.5 tp -68.69 -41.91 78.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.493 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -32.83 73.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.843 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.55 -47.19 76.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -66.29 -40.3 89.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.902 0.382 . . . . 0.0 110.704 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 1.0 OUTLIER -66.46 -33.58 76.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.094 0.473 . . . . 0.0 110.381 179.561 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.64 -31.79 68.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.102 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -46.52 73.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.32 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 420' ' ' LEU . 3.3 pp -65.24 -31.18 72.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.339 . . . . 0.0 110.939 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -70.09 -26.82 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 1.8 t -57.96 -25.92 61.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.159 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 23.7 t -66.63 134.86 29.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.89 0.376 . . . . 0.0 111.098 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -101.82 -177.79 3.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -151.13 138.38 19.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.86 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.87 28.27 16.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.547 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 97.16 43.68 2.97 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.467 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -116.43 129.05 56.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.862 0.363 . . . . 0.0 110.831 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -67.19 -37.45 83.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.34 -43.93 95.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.817 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 29.4 t -60.64 -46.1 96.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.08 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -34.3 74.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.782 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -64.71 -34.31 78.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.829 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.56 -43.64 69.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.155 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 438' ' ' ARG . 1.3 mmp_? -61.89 -44.53 96.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.924 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.49 -43.09 99.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.012 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.45 -45.0 95.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.074 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -70.88 -45.58 64.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.319 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.548 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 38.5 t -69.37 -30.7 46.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.025 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 54.1 t -70.66 -43.09 69.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.78 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.83 -44.58 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.062 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.548 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.8 pp -63.27 -31.12 51.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.765 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.48 -46.57 82.48 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.631 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -58.97 -36.79 75.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 24.4 mt -66.78 -36.53 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.9 tt -57.64 -58.71 7.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.813 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.94 -38.05 81.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.415 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.4 mmpp? -57.94 -29.88 65.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.415 ' CD1' HD22 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -71.33 -38.86 71.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.525 179.311 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.68 -29.98 65.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.121 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -20.7 23.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -20.6 36.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.768 0.318 . . . . 0.0 110.981 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.46 -90.33 0.18 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.329 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 112.447 -0.261 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.42 ' N ' ' CD ' ' A' ' 373' ' ' PRO . 0.5 OUTLIER -72.44 -51.51 7.41 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.63 0.252 . . . . 0.0 110.958 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 372' ' ' SER . 21.8 Cg_exo -64.84 82.4 0.18 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.603 2.202 . . . . 0.0 112.146 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 60.77 157.82 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.75 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -117.37 -60.73 1.79 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.856 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -104.17 142.59 24.92 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.788 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.451 ' HB2' HD13 ' A' ' 380' ' ' ILE . 35.0 Cg_exo -59.56 -175.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.356 2.037 . . . . 0.0 111.947 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.416 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 74.5 Cg_endo -90.43 10.72 2.87 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.722 2.281 . . . . 0.0 113.579 -179.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -124.66 -29.94 3.38 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.956 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.451 HD13 ' HB2' ' A' ' 377' ' ' PRO . 1.7 mp -58.6 -29.58 39.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.404 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.8 OUTLIER -56.94 -33.85 67.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.252 -179.517 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -68.43 -38.11 80.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.127 0.489 . . . . 0.0 110.827 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 40.7 mm -60.52 -33.98 56.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.524 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.3 OUTLIER -74.94 -44.78 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.584 178.582 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . 0.415 ' CG ' ' N ' ' A' ' 386' ' ' VAL . 0.0 OUTLIER -59.26 -49.47 77.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.511 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . 0.415 ' N ' ' CG ' ' A' ' 385' ' ' HIS . 14.7 p -64.0 -43.5 97.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.59 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.2 tt -60.7 -34.43 74.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.384 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.8 -35.01 78.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.519 178.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 -34.48 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.55 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 22.5 t -61.63 -46.85 95.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.488 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -64.98 -35.51 81.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.836 0.35 . . . . 0.0 110.797 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -40.8 74.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.632 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -41.7 97.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.618 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.21 -38.54 83.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.22 -35.34 80.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.826 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -69.27 -39.9 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 23.5 t -60.71 -44.85 98.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.028 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -55.76 -40.32 72.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 400' ' ' PHE . 15.3 tt0 -78.19 -53.93 6.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.304 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.593 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 35.1 t80 -22.65 123.28 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.09 -0.959 . . . . 0.0 113.145 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 11.6 p -118.33 24.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.444 178.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.593 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -61.09 -169.37 0.58 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.941 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.556 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.7 143.64 48.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.498 . . . . 0.0 111.17 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.16 -27.99 6.7 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.87 11.99 19.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.509 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 29.8 t70 -93.5 154.61 17.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 110.963 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -32.72 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.557 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -63.0 -45.9 90.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.897 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.556 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 11.8 t80 -61.34 -44.53 97.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.919 0.39 . . . . 0.0 110.672 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -59.13 -48.65 80.84 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.558 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.2 tp -65.01 -38.47 91.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' A' ' 408' ' ' ALA . 0.2 OUTLIER -61.04 -47.43 86.43 Favored 'General case' 0 C--N 1.339 0.113 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -70.68 -32.29 69.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.572 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.6 mt-10 -63.7 -39.65 94.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.838 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 1.6 ttt -69.45 -42.01 75.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.959 0.409 . . . . 0.0 110.167 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.04 -40.41 93.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.549 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 417' ' ' THR . . . . . 0.458 ' O ' ' HG ' ' A' ' 420' ' ' LEU . 2.7 m -64.13 -32.97 74.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.446 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.51 ' HA ' HD13 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -73.12 -23.58 60.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.81 -46.64 52.08 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.056 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.472 ' HB3' ' CD1' ' A' ' 445' ' ' ILE . 0.8 OUTLIER -64.79 -50.19 67.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.242 -178.965 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' A' ' 418' ' ' LYS . 0.0 OUTLIER -64.29 -31.38 72.57 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.176 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . 0.491 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 5.3 tp10 -64.25 -38.77 92.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . 0.423 ' CD2' ' CB ' ' A' ' 441' ' ' ALA . 0.4 OUTLIER -73.83 -31.19 63.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.007 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -74.16 -28.15 61.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.966 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 83.1 p -98.69 39.73 1.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 23.8 t -101.07 136.74 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.35 138.8 58.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.9 p -153.94 163.7 39.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.925 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -173.75 98.67 0.13 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.17 49.74 55.7 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.466 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -147.76 87.25 1.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.838 0.351 . . . . 0.0 110.952 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -64.58 -33.88 76.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.928 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 9.5 m -60.54 -44.74 95.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.923 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 32.6 t -66.53 -36.13 76.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.44 -39.15 85.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.861 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -69.1 -32.93 72.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.951 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.82 -45.23 62.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.237 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -62.23 -31.53 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.56 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -67.97 -37.52 81.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . 0.423 ' CB ' ' CD2' ' A' ' 423' ' ' LEU . . . -61.87 -45.66 92.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.865 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.499 ' O ' HG13 ' A' ' 445' ' ' ILE . 57.8 t -66.99 -36.31 76.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 16.0 m -70.9 -46.77 61.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.658 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -44.57 89.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.892 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 442' ' ' VAL . 2.8 pp -63.21 -31.36 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.191 0.52 . . . . 0.0 110.294 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -59.09 -47.73 84.19 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.586 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.13 -37.41 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.335 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 41.9 mt -69.08 -36.36 73.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.594 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.2 tt -57.49 -47.28 82.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.66 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -37.84 88.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.246 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -30.14 65.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.803 178.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.423 HD11 ' CE2' ' A' ' 400' ' ' PHE . 4.8 tp -73.09 -36.69 66.84 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.291 179.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -57.07 -29.92 63.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.477 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm -92.85 -12.45 31.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.29 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -25.48 33.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.925 0.393 . . . . 0.0 110.361 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.41 -70.19 1.31 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.459 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.946 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 60.18 160.03 0.11 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.717 0.294 . . . . 0.0 110.933 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.1 171.64 14.45 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.563 2.175 . . . . 0.0 112.335 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -136.02 120.21 17.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.859 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -119.4 -72.25 0.7 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 376' ' ' THR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 2.8 m -105.52 133.67 20.06 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.885 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.439 ' HD2' HG13 ' A' ' 380' ' ' ILE . 32.4 Cg_exo -58.74 171.56 1.97 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.466 2.111 . . . . 0.0 112.294 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -78.38 -29.05 4.11 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 123.079 2.519 . . . . 0.0 112.952 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 29.1 t -90.15 -26.24 20.28 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.439 HG13 ' HD2' ' A' ' 377' ' ' PRO . 33.5 mm -58.76 -29.7 40.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.431 ' HA ' HG12 ' A' ' 384' ' ' ILE . 4.0 mtpt -57.03 -33.19 66.95 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.019 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -66.7 -38.05 85.97 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.196 0.522 . . . . 0.0 110.841 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 18.9 mt -60.5 -35.74 65.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.308 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.431 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -75.03 -44.65 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.592 178.53 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -58.08 -49.38 77.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.893 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.23 -46.09 78.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.079 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.16 -36.46 81.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.941 0.4 . . . . 0.0 110.502 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.82 -34.76 77.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.739 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -36.36 74.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.785 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 15.6 t -66.84 -46.75 84.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.063 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -61.79 -37.5 84.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.627 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -72.4 -47.98 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.807 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 4.4 mt -60.73 -39.36 88.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.651 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -61.3 -40.66 94.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.751 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -31.83 73.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.737 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -68.79 -40.37 79.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . 0.445 ' CG1' ' HG ' ' A' ' 452' ' ' LEU . 30.3 t -60.64 -40.13 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.784 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.58 -37.0 70.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.119 0.485 . . . . 0.0 110.371 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -83.57 -54.38 4.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.254 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.614 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 51.2 t80 -27.69 109.18 0.04 OUTLIER 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.023 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 20.4 t -102.36 26.36 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.298 178.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.614 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -56.3 -175.91 0.25 Allowed Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.118 -179.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.496 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.66 48.25 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.819 -0.69 . . . . 0.0 111.511 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.427 ' HG2' ' CZ ' ' A' ' 409' ' ' TYR . 0.9 OUTLIER -53.5 -26.3 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.423 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 7.9 t -94.95 -15.48 23.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.552 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 9.2 t70 -77.44 142.29 39.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.762 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 46.2 mttm -61.71 -30.41 70.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.636 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.07 -29.08 70.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.728 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 24.3 t80 -67.77 -45.46 74.83 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.762 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.2 p-90 -72.73 -29.34 63.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.056 178.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.609 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.1 tp -69.54 -40.39 76.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.158 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.465 ' HG ' ' CD2' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.68 -46.96 87.49 Favored 'General case' 0 C--N 1.339 0.141 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.885 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -70.09 -31.52 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.521 177.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.609 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.6 OUTLIER -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.018 -179.181 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.49 -39.74 77.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.217 0.532 . . . . 0.0 109.896 178.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.401 ' O ' ' HG3' ' A' ' 419' ' ' GLU . 0.1 OUTLIER -60.6 -42.72 97.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.881 179.962 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 3.2 m -65.92 -32.72 74.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.689 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -47.21 84.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.569 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.497 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 0.0 OUTLIER -63.55 -34.55 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 0.4 OUTLIER -68.88 -41.2 78.66 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.916 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.75 -31.87 68.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.328 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 -46.55 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.943 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 420' ' ' LEU . 3.1 pp -58.81 -30.7 67.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.743 0.306 . . . . 0.0 111.261 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -91.75 31.77 1.18 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.371 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.34 -17.58 8.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.446 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.4 m -66.59 137.87 24.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.792 0.33 . . . . 0.0 111.386 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -87.73 86.47 7.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 5.5 p -84.22 131.99 34.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.795 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -93.19 -76.38 1.33 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.532 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -131.61 44.52 1.2 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.415 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -106.99 92.54 4.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.825 0.345 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -67.55 -40.39 84.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.989 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 76.6 p -58.66 -44.88 90.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.852 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.43 -39.89 87.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.981 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -58.88 -42.8 90.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -36.68 83.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.639 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.56 -40.61 95.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -44.3 81.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.9 mtpp -55.98 -35.25 66.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 110.629 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.05 -32.0 64.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.743 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.56 72.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.071 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.408 ' HA ' HG12 ' A' ' 445' ' ' ILE . 42.5 t -62.96 -39.21 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -38.56 85.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.517 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -35.45 80.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.353 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.408 HG12 ' HA ' ' A' ' 442' ' ' VAL . 2.5 mm -65.78 -31.2 52.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.707 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -44.45 85.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.442 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.62 -38.44 91.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.839 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 15.9 mt -74.67 -36.29 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.878 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.2 -51.64 68.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.675 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.47 -33.99 77.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 0.0 110.098 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -59.65 -31.71 69.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.848 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.445 ' HG ' ' CG1' ' A' ' 397' ' ' VAL . 0.4 OUTLIER -73.14 -36.61 66.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.448 179.265 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.21 -30.0 61.72 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.974 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -13.57 23.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.367 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -82.06 -26.26 33.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.171 0.51 . . . . 0.0 110.916 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.66 -97.97 0.74 Allowed Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.598 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.848 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.119 0 N-CA-C 112.511 -0.235 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -159.95 156.32 23.78 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.744 0.307 . . . . 0.0 110.826 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.15 177.09 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.524 2.149 . . . . 0.0 112.262 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -156.56 153.26 28.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.831 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . 0.403 ' CD2' ' OG1' ' A' ' 376' ' ' THR . 8.2 p90 -125.74 179.79 5.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.866 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 376' ' ' THR . . . . . 0.403 ' OG1' ' CD2' ' A' ' 375' ' ' PHE . 0.3 OUTLIER 62.56 105.38 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.828 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.67 168.37 0.76 Allowed 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.46 2.107 . . . . 0.0 112.3 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -75.53 -22.0 14.35 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.99 2.46 . . . . 0.0 112.985 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.3 m -98.61 -26.58 14.34 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.46 ' O ' HG22 ' A' ' 383' ' ' ILE . 30.6 mm -58.67 -29.9 40.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.403 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.79 -33.26 66.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.865 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -65.82 -41.16 92.16 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.325 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . 0.487 HG22 ' CD1' ' A' ' 384' ' ' ILE . 5.4 tp -60.68 -32.41 51.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.487 ' CD1' HG22 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -75.02 -44.78 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.714 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.98 -49.36 75.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.882 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 10.4 p -63.87 -37.34 79.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.861 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.4 tp -67.56 -37.73 83.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.67 -34.67 77.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.744 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -44.58 78.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.25 -35.95 74.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.136 0.493 . . . . 0.0 110.384 179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.32 -41.06 88.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.486 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.95 -42.87 99.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.303 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -38.08 76.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.447 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -59.37 -42.69 92.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.1 -41.1 82.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.779 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 49.3 mm-40 -69.27 -44.51 71.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.971 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 45.5 t -60.59 -33.45 54.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.532 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -57.01 -34.78 68.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.993 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.0 tt0 -89.99 -67.46 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.764 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.521 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 8.2 t80 43.4 111.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.805 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 9.8 m -95.76 23.6 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.157 178.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.521 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.69 -171.46 42.26 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.582 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.455 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.07 143.77 48.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.685 0.279 . . . . 0.0 111.666 -179.696 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.516 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.94 -25.56 30.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.214 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.05 0.37 37.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.436 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -92.14 149.5 21.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.34 . . . . 0.0 110.635 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.767 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.14 -30.16 70.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.852 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.82 -29.17 70.52 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.103 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.516 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.3 t80 -69.57 -45.56 68.41 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.767 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 4.8 p-90 -72.85 -30.99 64.45 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.961 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.609 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 36.6 tp -69.67 -38.4 77.03 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.471 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.471 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 11.2 tp -61.66 -47.34 85.81 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -70.41 -32.7 70.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.304 177.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.609 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mt-10 -64.01 -35.67 81.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.442 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 28.3 ttp -69.6 -40.66 76.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.653 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 1.9 mp -60.62 -45.74 92.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -33.45 75.11 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.643 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -59.41 -47.27 86.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.358 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -69.75 -38.11 76.67 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.35 -39.47 90.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.247 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.34 -31.84 69.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.782 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -46.21 91.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.781 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.24 -35.07 77.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.824 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.12 -31.26 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.803 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.8 t -60.31 -20.79 60.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 22.7 t -66.49 116.77 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.087 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.54 113.72 25.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.959 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 7.4 t -107.87 133.21 52.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -96.24 34.64 4.82 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.482 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 108.69 69.94 0.67 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.426 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -143.19 114.5 7.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.937 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -65.81 -35.27 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 42.2 t -60.14 -44.66 94.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 27.8 t -71.13 -42.89 75.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.995 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -67.78 -35.5 78.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.09 -35.26 76.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.853 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.13 76.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.136 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.63 -43.86 75.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.935 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -59.04 -44.83 91.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.767 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -62.48 -36.28 82.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.645 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.42 76.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.002 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 34.2 t -63.11 -45.9 97.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.051 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.91 -34.56 74.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.083 0.468 . . . . 0.0 110.322 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -63.18 -35.74 81.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.339 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . . . . . . . . . 2.6 mm -66.13 -35.51 75.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.473 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -58.25 -47.78 82.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.089 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.63 -37.07 85.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.966 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 7.8 mt -74.78 -36.5 40.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.144 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.39 -54.11 50.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.926 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -38.62 91.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.354 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . 0.438 ' O ' ' HD2' ' A' ' 455' ' ' LYS . 3.7 mttm -57.87 -35.19 70.64 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.46 -36.76 83.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.397 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.7 -29.91 70.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.789 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.71 -16.25 25.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.845 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.438 ' HD2' ' O ' ' A' ' 451' ' ' LYS . 0.3 OUTLIER -82.46 -22.6 35.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.797 0.332 . . . . 0.0 110.776 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.08 -79.77 0.67 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.374 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.835 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 20.6 p -139.17 63.67 30.37 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.832 0.349 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.21 173.06 0.24 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.566 2.178 . . . . 0.0 112.293 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -115.67 -83.48 0.62 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.97 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 62.61 -80.43 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.019 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.1 142.78 39.44 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.649 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.471 ' HG2' HG13 ' A' ' 380' ' ' ILE . 78.8 Cg_exo -49.94 178.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.478 2.118 . . . . 0.0 112.597 -179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -80.43 -23.29 6.2 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 123.238 2.626 . . . . 0.0 113.484 -178.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 96.7 p -106.32 -26.27 11.57 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.471 HG13 ' HG2' ' A' ' 377' ' ' PRO . 46.0 mm -58.65 -29.81 40.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 178.489 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.405 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.09 -33.35 67.21 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.052 -179.84 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -68.25 -38.21 81.55 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.099 0.476 . . . . 0.0 110.873 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 21.6 mt -60.54 -34.98 60.35 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.399 178.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.436 ' N ' HD12 ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.97 -44.72 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.426 178.615 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.04 -49.32 76.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.768 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 19.9 t -67.06 -39.34 83.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.012 179.838 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 4.2 tt -67.13 -35.65 80.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.474 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -62.71 -34.72 77.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.672 178.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.02 -34.6 73.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.424 179.704 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 32.6 t -67.7 -46.87 81.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.096 179.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -59.46 -41.03 88.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.946 0.403 . . . . 0.0 110.538 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.37 -37.39 77.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.231 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.97 -38.66 91.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.381 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -59.11 -45.07 91.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.461 179.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -60.98 -33.52 73.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.631 179.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.25 -40.7 77.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.813 179.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 24.4 t -60.68 -33.27 54.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.472 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -28.51 64.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.174 0.512 . . . . 0.0 110.135 178.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 24.3 tt0 -91.69 -53.39 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.886 179.119 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.66 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 46.1 t80 -20.78 112.64 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.231 179.823 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.8 p -104.07 26.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.619 178.243 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.66 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -58.91 -177.66 0.93 Allowed Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.781 -0.724 . . . . 0.0 113.065 -179.309 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.518 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.62 48.22 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.834 -0.683 . . . . 0.0 111.543 -179.999 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.43 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -52.56 -27.15 15.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.319 179.355 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.5 -15.55 20.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.493 -179.707 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -74.52 144.17 44.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.747 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.1 OUTLIER -62.81 -30.83 71.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.813 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.09 70.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.803 179.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.518 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 41.2 t80 -68.36 -45.58 72.43 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.747 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -72.94 -29.37 63.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.949 177.921 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.61 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 20.2 tp -69.61 -38.43 77.26 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.14 177.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -47.32 85.86 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 3.7 tt0 -70.63 -32.26 69.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.646 177.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.61 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.87 -38.97 93.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.198 -179.367 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.504 ' O ' ' HG3' ' A' ' 418' ' ' LYS . 50.3 ttp -69.64 -44.79 69.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.339 . . . . 0.0 110.859 -179.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.49 -37.11 77.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.505 179.641 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 417' ' ' THR . . . . . 0.434 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 1.2 t -70.26 -44.28 68.77 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -61.68 -38.61 88.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.726 0.298 . . . . 0.0 110.931 -179.627 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -72.27 -46.33 56.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.11 179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.434 ' CD2' ' HA ' ' A' ' 417' ' ' THR . 1.7 pp -66.61 -34.29 77.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.5 -38.44 89.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.937 179.249 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.89 -44.3 97.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.298 179.51 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.06 -38.08 85.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.708 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.04 -26.47 65.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.009 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 4.3 p -96.8 38.33 1.23 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.931 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 10.9 p -88.92 133.53 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.45 98.68 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.8 t -114.22 129.55 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.947 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -158.46 100.06 0.19 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.462 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.21 49.89 54.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.458 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . 0.433 ' O ' HG11 ' A' ' 434' ' ' VAL . 32.4 mt-30 -152.2 108.63 3.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.867 0.365 . . . . 0.0 110.926 179.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.69 -28.82 68.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.5 m -59.8 -44.93 93.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.724 -179.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . 0.433 HG11 ' O ' ' A' ' 431' ' ' GLN . 10.8 p -72.44 -35.25 51.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 111.328 -179.588 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -42.44 94.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.803 0.335 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -69.29 -32.88 72.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.43 -45.23 63.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.199 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -68.36 -35.08 77.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.775 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -66.24 -35.79 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.793 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.6 -45.42 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.23 95.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.546 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 24.5 t -63.33 -31.34 52.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.83 -46.7 62.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.98 179.774 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -67.01 -44.69 79.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.218 -179.796 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.546 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.0 pp -63.3 -31.08 51.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.98 0.419 . . . . 0.0 110.937 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.09 -44.62 91.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.584 179.692 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.13 77.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.284 -179.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 22.0 mt -73.3 -36.59 49.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.174 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.57 -57.64 11.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.026 -179.768 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -33.18 74.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.744 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -31.88 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.976 0.417 . . . . 0.0 110.365 179.6 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.412 ' CD1' ' CD2' ' A' ' 416' ' ' LEU . 2.7 mt -77.61 -36.63 51.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.796 179.619 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -56.04 -30.01 61.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.769 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -90.35 -22.43 21.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.737 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -19.2 39.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.031 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.03 -98.9 0.14 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.483 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.89 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 60.3 m -81.38 147.63 60.68 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.67 0.271 . . . . 0.0 110.843 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.27 -50.88 12.43 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.594 2.196 . . . . 0.0 112.384 179.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 60.09 109.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.88 -179.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -92.45 -75.9 0.47 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.129 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.21 96.91 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.676 -179.831 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.587 ' HG2' HG13 ' A' ' 380' ' ' ILE . 44.7 Cg_exo -59.27 155.85 38.32 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.568 2.178 . . . . 0.0 112.268 -179.701 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 377' ' ' PRO . 5.9 Cg_exo -78.51 -10.64 15.92 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.935 2.423 . . . . 0.0 113.354 -179.158 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 10.7 p -114.73 -27.88 7.3 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 120.675 -0.41 . . . . 0.0 112.025 -179.356 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.587 HG13 ' HG2' ' A' ' 377' ' ' PRO . 33.2 mm -58.6 -29.76 40.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.547 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -59.35 -33.32 71.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.811 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -68.09 -38.07 81.93 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.246 0.546 . . . . 0.0 110.764 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 387' ' ' LEU . 40.1 mm -60.48 -33.95 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.477 178.945 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -74.94 -44.49 44.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.169 178.293 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -56.82 -45.98 81.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.696 179.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 13.5 p -69.36 -44.16 80.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.695 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 383' ' ' ILE . 0.3 OUTLIER -66.12 -35.11 79.62 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.745 179.87 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.81 -34.98 78.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.304 0.573 . . . . 0.0 109.526 178.784 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -67.16 -40.78 86.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.591 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.572 HG12 ' N ' ' A' ' 391' ' ' GLN . 4.3 p -63.17 -35.62 72.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.817 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.572 ' N ' HG12 ' A' ' 390' ' ' VAL . 1.0 OUTLIER -63.22 -41.07 99.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.816 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -64.23 -44.96 90.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.69 -40.6 84.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.986 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -60.15 -39.44 86.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.944 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -36.24 82.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.132 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.48 -40.62 85.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.093 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 18.1 t -60.68 -39.19 80.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.65 -40.37 75.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.979 0.418 . . . . 0.0 110.388 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' C ' ' A' ' 400' ' ' PHE . 17.6 tt0 -77.34 -54.86 5.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.169 179.35 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.512 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 41.8 t80 -11.76 110.92 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.525 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 p -104.49 24.92 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.515 178.193 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.512 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -64.4 -169.05 1.71 Allowed Glycine 0 N--CA 1.442 -0.925 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.873 -179.347 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.564 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.86 143.55 48.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.351 -0.424 . . . . 0.0 111.253 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.438 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -52.79 -24.07 8.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.781 179.853 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 -5.03 21.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.521 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.45 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 24.3 t70 -77.84 156.13 30.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.773 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 41.0 mtmt -68.97 -32.87 72.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.292 179.587 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' A' ' 411' ' ' LEU . . . -62.83 -29.2 70.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 178.924 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.564 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 19.8 t80 -63.04 -45.23 93.23 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.827 -179.118 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.773 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.6 OUTLIER -72.62 -27.91 62.44 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 118.763 -1.175 . . . . 0.0 108.74 177.83 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.7 mp -66.48 -41.53 88.84 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.28 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.464 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.82 -46.78 88.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.813 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . 0.403 ' CG ' ' CD2' ' A' ' 449' ' ' LEU . 2.1 tm-20 -70.23 -31.94 69.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.593 177.921 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.555 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.0 OUTLIER -63.49 -42.22 98.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.339 -179.059 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 4.1 mmt -69.53 -44.33 71.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.078 0.466 . . . . 0.0 110.622 179.622 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.413 HD12 ' CD1' ' A' ' 412' ' ' LEU . 4.3 mt -61.68 -44.34 97.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 23.7 m -62.58 -30.46 71.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 -179.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.457 ' O ' HD11 ' A' ' 421' ' ' LEU . 14.7 mttt -64.31 -43.39 94.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.062 0.458 . . . . 0.0 110.261 179.42 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.73 -37.78 67.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.991 179.178 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.4 ' HB2' ' CB ' ' A' ' 445' ' ' ILE . 0.3 OUTLIER -66.86 -50.51 62.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.385 -179.812 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . 0.478 ' CD1' ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.33 -31.5 68.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.986 -179.567 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . 0.478 ' N ' ' CD1' ' A' ' 421' ' ' LEU . 0.8 OUTLIER -59.64 -46.34 89.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.781 0.324 . . . . 0.0 110.883 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.4 -31.02 71.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.991 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.07 -0.82 41.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.535 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 33.8 p -79.51 -37.25 37.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.825 0.345 . . . . 0.0 110.971 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 27.6 m -74.21 133.77 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.166 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -86.56 -22.22 26.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.069 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.5 t 43.53 85.52 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.525 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.21 46.98 1.64 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.449 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 144.92 52.57 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.465 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -164.14 95.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.86 0.362 . . . . 0.0 110.912 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -65.87 -33.93 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.867 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 27.9 t -59.15 -37.45 77.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 30.8 t -74.43 -41.9 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.088 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . 0.402 ' HA ' ' HD3' ' A' ' 438' ' ' ARG . 0.0 OUTLIER -59.61 -44.25 93.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 -179.983 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -67.47 -35.76 79.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.046 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . 0.408 ' CB ' ' CG2' ' A' ' 383' ' ' ILE . . . -73.11 -45.12 58.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.471 -179.767 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 438' ' ' ARG . 0.1 OUTLIER -66.17 -40.11 90.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.947 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -36.12 82.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.707 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.06 -42.82 62.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.811 179.784 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.56 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . . . . . . . . . 43.2 t -65.11 -46.04 92.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.966 0.412 . . . . 0.0 110.813 179.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 8.7 m -61.97 -35.14 77.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.522 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . 0.419 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.1 -38.03 89.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.389 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.467 ' N ' HD12 ' A' ' 445' ' ' ILE . 1.5 mp -67.08 -31.32 52.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.05 -45.79 90.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.712 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.5 -37.62 85.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 444' ' ' LYS . 10.1 mt -70.34 -36.41 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.805 179.699 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . 0.403 ' CD2' ' CG ' ' A' ' 413' ' ' GLU . 20.0 mt -57.19 -50.22 73.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.63 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.42 -41.85 75.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 110.123 179.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.83 -30.04 65.44 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.544 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 11.4 tp -71.25 -36.64 71.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.323 179.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -56.31 -29.93 61.9 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.587 179.45 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -89.91 -17.13 28.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.904 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -22.41 35.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.717 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.09 -81.61 0.43 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.151 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 2.5 pp . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.947 179.851 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 23.0 t -60.69 110.35 2.85 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.504 0.192 . . . . 0.0 111.016 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.48 90.1 1.23 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.453 2.102 . . . . 0.0 112.309 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -67.43 110.5 3.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.901 179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -111.35 99.16 8.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.23 151.67 43.29 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.808 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.406 ' HD2' HD11 ' A' ' 380' ' ' ILE . 78.1 Cg_exo -51.35 -177.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.667 2.245 . . . . 0.0 112.393 179.981 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -87.98 -12.21 4.29 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.771 2.314 . . . . 0.0 113.467 -179.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.9 p -115.94 -21.57 9.45 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.502 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.406 HD11 ' HD2' ' A' ' 377' ' ' PRO . 3.2 mt -58.82 -30.11 41.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.609 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.416 ' HA ' HG12 ' A' ' 384' ' ' ILE . 6.5 mmmt -57.04 -33.23 67.01 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.867 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -38.09 83.69 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.154 0.502 . . . . 0.0 110.808 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 39.4 mm -60.44 -34.33 57.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.445 178.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.432 ' N ' HD12 ' A' ' 384' ' ' ILE . 0.3 OUTLIER -74.86 -44.72 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.396 178.517 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -57.37 -49.1 77.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.573 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.97 -40.74 88.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.824 179.634 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.402 ' O ' ' CG1' ' A' ' 390' ' ' VAL . 3.2 tt -66.01 -35.06 79.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.906 0.384 . . . . 0.0 110.622 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -34.97 78.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.905 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -67.75 -39.54 84.17 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.604 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.568 HG12 ' N ' ' A' ' 391' ' ' GLN . 4.3 p -64.48 -35.57 74.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.483 179.635 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.568 ' N ' HG12 ' A' ' 390' ' ' VAL . 1.0 OUTLIER -61.77 -41.02 97.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.349 179.596 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -67.81 -46.52 71.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.491 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 42.7 mt -62.11 -37.97 87.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.487 179.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -37.36 79.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.645 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -64.04 -42.39 97.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.606 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -69.04 -40.19 78.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.715 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . 0.404 ' O ' ' HE3' ' A' ' 455' ' ' LYS . 22.1 t -60.6 -36.71 72.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.672 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.61 -35.75 66.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.175 0.512 . . . . 0.0 110.107 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -90.07 -66.83 0.89 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.813 178.998 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.559 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 9.6 t80 31.21 108.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 179.292 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 17.4 t -95.49 25.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.165 178.177 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.559 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -87.03 -174.83 49.15 Favored Glycine 0 N--CA 1.442 -0.914 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.683 -179.719 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.7 OUTLIER -134.21 143.69 48.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.603 -0.299 . . . . 0.0 111.755 -179.787 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.491 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.1 -25.62 32.55 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.083 179.151 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.4 m -105.33 14.51 28.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.223 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.75 151.84 24.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.763 179.831 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.725 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.1 -30.26 70.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 -179.827 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -64.4 -29.28 70.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 179.828 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.491 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 3.5 t80 -71.17 -45.67 62.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.369 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.725 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.1 p-90 -73.07 -29.62 63.09 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.849 177.908 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -69.65 -40.75 76.31 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.768 177.994 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.474 HD23 ' CD2' ' A' ' 400' ' ' PHE . 1.6 tp -61.97 -46.97 86.93 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.078 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.37 -32.2 69.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.758 177.961 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.57 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 1.3 mm-40 -63.61 -38.66 91.95 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.91 -179.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 42.9 ttp -69.6 -41.59 75.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.994 0.426 . . . . 0.0 110.28 179.332 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.29 -45.1 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.684 179.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 2.0 m -62.73 -32.59 73.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.712 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -61.46 -42.82 99.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.537 179.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -67.49 -46.4 73.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.282 179.614 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -59.87 -38.53 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.441 179.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.9 mp -64.88 -31.8 73.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.56 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.07 -46.27 88.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 37.3 mt -65.34 -33.99 77.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.869 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -5.18 54.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.3 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 32.2 t -89.37 10.64 21.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.609 0.242 . . . . 0.0 111.374 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 30.0 t -93.54 115.6 32.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.855 0.36 . . . . 0.0 110.912 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -82.14 87.69 6.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.905 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 9.9 t -73.79 149.81 41.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.845 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -127.66 41.31 1.61 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.518 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.11 -27.47 4.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.528 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 47.7 tp60 -58.53 92.48 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 0.0 111.043 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -66.44 -29.71 69.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.1 m -57.74 -44.15 85.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.984 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 29.5 t -64.86 -36.88 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.061 -180.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -62.18 -40.91 97.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.858 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -36.13 77.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.87 -45.19 64.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.105 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -69.22 -35.06 75.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -65.46 -39.58 92.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.513 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.27 -38.0 89.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.566 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.0 -42.23 98.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.801 179.812 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.552 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 11.8 t -62.97 -32.51 56.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.833 179.83 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.67 -40.59 72.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.777 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -72.97 -44.59 60.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.856 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.552 ' CG1' ' HA ' ' A' ' 442' ' ' VAL . 2.8 pp -64.66 -31.09 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.076 0.465 . . . . 0.0 110.624 179.575 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.15 -44.03 85.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.449 179.7 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.3 -37.35 80.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.948 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 29.7 mt -70.99 -36.51 63.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.863 179.737 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -53.22 60.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.942 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.99 -41.07 91.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.466 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.79 -30.6 65.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 4.1 tp -70.37 -36.48 74.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.334 179.124 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -29.73 61.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.598 179.565 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.5 -12.19 30.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.475 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' A' ' 397' ' ' VAL . 0.0 OUTLIER -82.44 -25.55 33.53 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.896 0.379 . . . . 0.0 110.484 179.708 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.39 -73.7 1.15 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.395 179.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . 0.406 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.852 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.166 0 N-CA-C 112.525 -0.23 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 61.19 77.19 0.37 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.797 0.332 . . . . 0.0 110.921 179.955 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -68.15 -12.6 35.6 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.507 2.138 . . . . 0.0 112.461 179.831 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 68.7 -68.72 0.17 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.096 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -147.59 142.04 26.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.846 0.355 . . . . 0.0 110.964 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 53.27 64.25 7.23 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.967 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.518 ' HG2' HG13 ' A' ' 380' ' ' ILE . 52.7 Cg_exo -55.95 172.54 0.55 Allowed 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.614 2.21 . . . . 0.0 112.158 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . 0.429 ' HD2' ' HB3' ' A' ' 377' ' ' PRO . 23.0 Cg_endo -63.98 -78.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.533 2.155 . . . . 0.0 113.896 -178.819 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -22.36 66.4 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.34 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.518 HG13 ' HG2' ' A' ' 377' ' ' PRO . 31.8 mm -58.75 -29.93 41.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.773 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.422 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -56.92 -33.27 66.78 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.583 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.34 -37.93 81.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.19 0.519 . . . . 0.0 110.473 179.473 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . 0.415 ' CD1' ' CZ ' ' A' ' 438' ' ' ARG . 19.4 mm -60.31 -33.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.441 178.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 384' ' ' ILE . 0.3 OUTLIER -74.88 -44.68 44.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.471 178.493 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -58.42 -49.36 77.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.686 179.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 77.6 t -65.94 -43.95 92.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.753 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.44 -35.8 78.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.898 0.38 . . . . 0.0 110.505 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 4.5 mt-10 -62.79 -34.92 78.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.232 0.539 . . . . 0.0 109.637 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.25 -34.52 72.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.569 179.669 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 36.8 t -62.42 -46.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.455 -179.714 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.8 pt20 -64.32 -36.34 83.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -34.99 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.188 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -37.91 82.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.261 179.429 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -39.1 79.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.615 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -39.2 80.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.458 179.659 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.4 -44.58 71.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.223 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 21.8 t -60.82 -47.49 93.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.414 -179.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.66 -29.91 64.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.696 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -87.57 -57.63 2.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.975 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.559 ' CE1' ' HG ' ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.76 128.75 36.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.905 -179.853 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 402' ' ' GLY . 29.4 m -124.37 40.55 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.414 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.524 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.97 -163.44 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.002 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.53 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.24 143.67 49.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.01 0.433 . . . . 0.0 111.44 -179.354 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.447 ' HA ' ' CE1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.23 -24.48 27.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.861 -179.888 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.69 14.03 24.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.352 -179.797 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . 0.527 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t0 -95.62 154.07 17.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.37 . . . . 0.0 111.171 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -71.36 -43.48 66.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.704 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.94 -33.1 74.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.535 179.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.53 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 4.0 t80 -67.59 -44.24 78.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.287 179.634 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.436 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -56.01 -48.44 75.9 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.43 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.548 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -60.11 -37.96 81.58 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.111 176.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.559 ' HG ' ' CE1' ' A' ' 400' ' ' PHE . 0.1 OUTLIER -59.4 -47.73 84.33 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.483 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -71.02 -32.64 69.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.53 177.432 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.16 -46.5 83.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 114.992 -1.003 . . . . 0.0 111.644 -179.312 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -64.56 -39.68 94.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.744 0.306 . . . . 0.0 110.856 -179.812 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.69 -38.41 84.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.926 0.393 . . . . 0.0 110.708 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.3 m -67.54 -38.53 84.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.114 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.09 -40.92 82.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.004 -179.853 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.5 -46.34 86.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.013 0.435 . . . . 0.0 110.136 179.635 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . 0.409 ' HB2' ' CD1' ' A' ' 445' ' ' ILE . 2.7 tm? -62.14 -37.34 84.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.442 179.422 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -70.5 -31.8 69.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -46.39 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.141 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.2 pp -67.91 -30.76 70.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.12 -179.842 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -83.92 11.33 7.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.595 -179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 26.9 t -100.27 -19.02 16.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.682 0.277 . . . . 0.0 111.359 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 29.8 m -66.61 137.84 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.903 0.382 . . . . 0.0 111.167 -179.79 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.86 149.04 29.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.931 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -148.06 118.08 7.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.927 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -78.52 -50.89 5.86 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.985 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -172.22 35.97 0.15 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.421 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.28 102.59 14.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.875 0.369 . . . . 0.0 110.895 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -60.14 -30.53 69.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.886 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -44.86 92.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.857 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 23.4 t -75.11 -42.48 44.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.985 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -63.08 -39.68 95.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.821 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -68.08 -37.58 81.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.08 -34.53 66.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.224 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . 0.415 ' CZ ' ' CD1' ' A' ' 383' ' ' ILE . 0.1 OUTLIER -69.83 -44.53 69.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.799 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 440' ' ' GLU . 0.0 OUTLIER -64.65 -31.5 72.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 110.509 179.661 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 8.7 tp10 -65.89 -40.06 91.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.52 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.58 92.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.631 179.7 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.536 ' HA ' HG12 ' A' ' 445' ' ' ILE . 12.3 t -62.95 -30.88 50.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.772 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -45.67 65.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.944 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -44.14 96.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.536 HG12 ' HA ' ' A' ' 442' ' ' VAL . 34.3 pt -64.8 -31.22 52.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.043 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . 0.416 ' N ' HG13 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -62.8 -40.95 98.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.223 179.733 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.51 -35.63 80.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.36 179.392 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 19.3 mt -74.8 -36.67 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.665 179.489 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.61 -47.54 81.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.626 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.2 -40.95 90.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.302 179.477 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -30.11 65.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.086 0.47 . . . . 0.0 109.894 178.956 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.403 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -76.25 -36.73 58.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.416 179.392 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -41.53 93.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -78.96 -20.99 47.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.186 -179.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.42 -19.97 37.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.902 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.33 -88.44 0.35 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.478 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.203 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 77.7 p -169.63 81.51 0.64 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.72 0.295 . . . . 0.0 110.859 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.89 154.56 67.11 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.503 2.135 . . . . 0.0 112.247 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -59.62 163.23 4.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -91.59 50.01 1.66 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 376' ' ' THR . . . . . 0.42 ' CG2' ' HD2' ' A' ' 377' ' ' PRO . 0.2 OUTLIER -76.51 146.88 77.9 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 179.981 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . 0.738 ' CG ' ' HB ' ' A' ' 380' ' ' ILE . 42.4 Cg_endo -65.14 178.7 1.81 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.768 2.312 . . . . 0.0 112.492 179.889 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -92.92 -60.19 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.099 2.533 . . . . 0.0 113.191 -179.657 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 15.5 t -86.75 -32.71 20.26 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 120.653 0.263 . . . . 0.0 111.611 -179.215 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 380' ' ' ILE . . . . . 0.738 ' HB ' ' CG ' ' A' ' 377' ' ' PRO . 3.0 mp -58.66 -29.53 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.704 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 381' ' ' LYS . . . . . 0.42 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.8 -33.4 66.63 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.796 179.838 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -68.32 -37.97 81.08 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.221 0.534 . . . . 0.0 110.505 179.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 48.6 mt -60.45 -33.96 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.408 178.827 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 384' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.3 OUTLIER -74.95 -44.67 44.51 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.194 178.424 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -59.49 -49.34 78.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.602 179.721 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 13.7 p -63.83 -35.45 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.368 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.9 tt -67.44 -34.29 76.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.262 179.454 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 388' ' ' GLU . . . . . 0.404 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 0.3 OUTLIER -62.76 -35.15 78.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.601 179.017 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -35.43 73.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.569 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 32.9 t -69.25 -46.82 76.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 391' ' ' GLN . . . . . 0.404 ' HG2' ' HA ' ' A' ' 388' ' ' GLU . 14.8 pt20 -58.36 -37.99 76.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.661 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -67.19 -42.86 83.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.435 179.556 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 393' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.34 -37.92 89.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.332 179.368 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -39.16 81.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.542 179.653 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -63.12 -43.22 99.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.46 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.22 -42.07 76.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.492 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 397' ' ' VAL . . . . . . . . . . . . . 50.7 t -60.63 -32.17 50.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.398 179.472 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.7 -40.04 86.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.973 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.406 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.9 tt0 -86.51 -68.77 0.72 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.846 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.599 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 4.5 t80 57.13 144.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.16 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 11.9 t -125.98 21.62 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.916 178.701 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 402' ' ' GLY . . . . . 0.599 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -110.93 179.37 20.02 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.472 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 403' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.34 151.43 51.23 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.363 -0.419 . . . . 0.0 111.713 -179.618 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 404' ' ' LYS . . . . . 0.539 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.5 -31.91 25.58 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.128 179.233 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 8.9 t -97.2 15.67 22.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.196 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -115.23 155.06 27.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.848 0.356 . . . . 0.0 110.959 179.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 407' ' ' LYS . . . . . 0.773 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 4.0 mtmp? -61.72 -30.04 70.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.891 179.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.83 -29.24 70.58 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 409' ' ' TYR . . . . . 0.539 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 10.7 t80 -70.55 -45.81 64.77 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -178.61 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 410' ' ' TRP . . . . . 0.773 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -72.94 -29.12 62.86 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 118.804 -1.158 . . . . 0.0 108.888 177.979 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 411' ' ' LEU . . . . . 0.589 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 33.3 tp -69.59 -38.66 77.43 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.258 178.091 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.477 ' CD2' ' CD1' ' A' ' 400' ' ' PHE . 11.6 tp -62.15 -47.17 85.75 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.796 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.49 -32.14 69.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.732 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 414' ' ' GLU . . . . . 0.589 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.62 -46.59 85.04 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -178.982 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 415' ' ' MET . . . . . 0.488 ' HG3' HD11 ' A' ' 416' ' ' LEU . 2.5 ptt? -64.47 -38.72 92.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 110.272 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.488 HD11 ' HG3' ' A' ' 415' ' ' MET . 8.7 mp -68.88 -37.17 78.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.632 179.233 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 81.4 m -67.15 -35.67 80.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -179.257 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.455 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.1 OUTLIER -72.16 -34.54 68.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.573 0.225 . . . . 0.0 111.594 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 419' ' ' GLU . . . . . 0.437 ' N ' ' HG3' ' A' ' 418' ' ' LYS . 9.0 pt-20 -72.2 -41.99 66.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.675 0.274 . . . . 0.0 111.043 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 420' ' ' LEU . . . . . . . . . . . . . 1.2 pp -67.49 -38.19 83.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.822 0.344 . . . . 0.0 110.755 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.32 -33.24 73.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.711 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -40.3 95.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.778 179.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -31.9 65.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.801 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -31.47 72.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.804 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 40.4 t -59.63 -26.47 65.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 40.6 t -66.63 126.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.23 176.43 7.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 3.9 t -162.59 160.28 25.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.864 179.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -146.87 85.91 0.17 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 65.49 28.26 73.4 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.481 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -106.81 94.47 5.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.804 0.335 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.99 -33.65 72.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -39.62 94.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.881 179.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 434' ' ' VAL . . . . . . . . . . . . . 24.5 t -76.04 -46.17 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.104 -179.957 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.04 -40.32 95.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.842 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -69.32 -35.18 75.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.935 179.907 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.2 -45.18 57.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.456 -179.738 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.55 -40.02 84.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.884 -179.87 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.46 -44.87 85.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.026 0.441 . . . . 0.0 110.355 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -61.52 -31.6 71.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.285 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.28 -38.8 91.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.876 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 442' ' ' VAL . . . . . 0.415 ' O ' ' CG ' ' A' ' 446' ' ' GLN . 26.8 t -62.64 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 443' ' ' CYS . . . . . 0.642 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.3 m -60.7 -30.01 69.68 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . 0.424 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.55 -41.6 98.43 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.769 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 445' ' ' ILE . . . . . 0.405 ' N ' ' CD1' ' A' ' 445' ' ' ILE . 0.6 OUTLIER -73.67 -35.26 43.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.508 0.671 . . . . 0.0 109.821 178.669 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . 0.642 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.4 OUTLIER -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.285 179.438 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.47 -40.45 86.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.121 179.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 448' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 444' ' ' LYS . 10.1 mt -72.75 -36.15 51.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.21 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -41.54 78.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.027 -179.198 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.5 -42.77 67.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -29.97 65.62 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.612 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.438 ' HG ' HD21 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -71.32 -36.64 71.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.677 179.349 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.16 -29.86 61.4 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . 0.406 ' HA ' ' CE ' ' A' ' 454' ' ' LYS . 1.0 OUTLIER -98.41 -8.92 26.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.824 -179.809 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.52 -26.0 32.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 110.872 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -83.65 -73.57 1.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.276 -179.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.865 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 56.3 p . . . . . 0 CA--C 1.519 -0.224 0 CA-C-O 120.676 0.274 . . . . 0.0 111.485 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.654 HG22 HD11 ' A' ' 384' ' ' ILE . 37.7 mm -58.68 -29.75 40.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.492 ' HA ' HG12 ' A' ' 384' ' ' ILE . 30.4 mttp -56.71 -33.23 66.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.688 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.0 OUTLIER -67.18 -37.95 84.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.078 0.466 . . . . 0.0 110.773 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.44 -34.71 58.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.483 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.654 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.9 -44.68 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.316 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.31 -43.72 88.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.279 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 382' ' ' LYS . 42.5 t -70.31 -42.91 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.63 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.911 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -66.09 -35.09 79.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 179.657 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.86 -34.96 78.45 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -40.85 87.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.548 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.911 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -63.59 -35.54 73.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -40.97 98.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.513 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -70.44 -35.53 73.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.504 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.76 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.9 OUTLIER -65.22 -38.56 90.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.516 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.66 -46.88 87.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.543 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.96 -32.52 73.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.603 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -38.25 78.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.935 HG21 ' CG2' ' A' ' 448' ' ' ILE . 21.7 t -60.69 -41.98 90.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.858 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -55.63 -34.55 65.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.02 0.438 . . . . 0.0 110.468 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -84.45 -54.34 4.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.153 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.597 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.8 t80 -27.42 112.55 0.06 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.001 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.9 p -105.13 26.81 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.53 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.597 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -57.64 -170.22 0.18 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.173 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.95 143.88 48.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.217 -0.492 . . . . 0.0 111.486 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -30.56 3.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.068 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.8 t -115.48 15.77 16.68 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.485 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 0.3 OUTLIER -83.11 150.49 26.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.871 0.367 . . . . 0.0 110.859 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.534 ' O ' HD23 ' A' ' 411' ' ' LEU . 9.8 mmtm -63.41 -30.66 71.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.213 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -73.17 -38.86 66.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.967 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.535 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 16.7 t80 -60.12 -44.36 94.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.566 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.462 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -58.92 -48.82 80.1 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.653 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.587 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -64.27 -38.05 89.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.746 ' O ' HD12 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -59.58 -47.56 85.08 Favored 'General case' 0 CA--C 1.523 -0.089 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -32.64 69.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.223 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.587 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.18 -46.4 84.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.233 -179.679 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.717 ' SD ' HD21 ' A' ' 393' ' ' LEU . 17.3 ptp -62.85 -40.37 97.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.816 0.341 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 412' ' ' LEU . 1.3 mt -63.33 -48.15 79.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.449 . . . . 0.0 110.541 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.7 m -64.82 -30.39 71.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -62.19 -47.3 85.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.129 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.453 ' OE2' HG23 ' A' ' 390' ' ' VAL . 3.8 pt-20 -63.58 -34.81 78.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.027 0.442 . . . . 0.0 110.14 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.921 HD23 HD11 ' A' ' 423' ' ' LEU . 0.4 OUTLIER -69.01 -33.94 74.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.037 179.217 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.4 mp -70.34 -31.87 69.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.995 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.44 -46.38 60.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.814 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.921 HD11 HD23 ' A' ' 420' ' ' LEU . 4.5 pp -68.47 -30.82 69.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.96 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 424' ' ' ASP . . . . . 0.677 ' N ' HD12 ' A' ' 423' ' ' LEU . 15.6 t70 -92.68 29.74 1.7 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.217 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.3 t -109.24 -17.16 13.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.958 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 13.5 m -66.59 137.34 25.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 427' ' ' GLU . . . . . 0.49 ' O ' HG22 ' A' ' 428' ' ' THR . 0.3 OUTLIER -84.12 -46.75 11.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.947 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 427' ' ' GLU . 14.8 t 45.47 -167.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.358 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -169.65 -51.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.577 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.94 36.18 2.1 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.494 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.502 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.9 OUTLIER -103.84 103.27 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.906 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.5 -39.69 85.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -40.95 86.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.502 HG23 ' HB3' ' A' ' 431' ' ' GLN . 39.1 t -69.8 -46.28 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.165 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -39.33 83.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.012 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -69.15 -45.12 70.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.141 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -69.11 -37.58 78.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.291 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.856 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.0 OUTLIER -63.86 -44.55 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.052 -179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 34.1 tttp -67.96 -43.17 79.64 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.197 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -64.08 -39.41 94.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.1 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.59 86.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.22 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.888 HG22 HD21 ' A' ' 420' ' ' LEU . 20.3 t -62.64 -35.45 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.86 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 6.8 m -63.08 -36.05 82.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.436 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -64.39 -41.71 96.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.706 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.92 HG21 HD12 ' A' ' 420' ' ' LEU . 2.2 mp -63.36 -31.17 51.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -41.73 90.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.691 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.19 91.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.071 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.935 ' CG2' HG21 ' A' ' 397' ' ' VAL . 34.0 mt -73.61 -36.53 47.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.142 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.613 HD12 HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.5 -44.76 85.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.971 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.12 -40.93 67.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.852 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -30.93 66.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 110.067 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.545 HD11 HD12 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -77.58 -36.64 51.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.565 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -56.15 -30.0 61.55 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.805 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 10.5 pttt -90.37 -16.58 28.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.266 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -82.46 -23.5 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.668 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.57 -91.87 0.23 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.478 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.873 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 CA--C 1.519 -0.234 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.837 ' HA ' HD12 ' A' ' 383' ' ' ILE . 36.8 mm -58.65 -30.06 40.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.41 ' HA ' HG12 ' A' ' 384' ' ' ILE . 10.0 mmtp -56.8 -33.26 66.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -68.38 -39.85 81.61 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 111.218 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 1.019 HG21 ' HB1' ' A' ' 437' ' ' ALA . 4.4 mt -60.6 -31.79 49.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.673 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.72 HD11 HG22 ' A' ' 380' ' ' ILE . 0.4 OUTLIER -74.77 -44.3 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.44 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.16 178.53 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -56.37 -46.19 80.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.279 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.418 ' O ' HG23 ' A' ' 390' ' ' VAL . 96.6 t -68.44 -37.3 77.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.138 178.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 383' ' ' ILE . 0.2 OUTLIER -67.52 -35.19 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.256 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -62.8 -35.0 78.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.67 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -38.81 88.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.285 179.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 386' ' ' VAL . 24.2 t -69.74 -35.89 67.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.635 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -40.87 83.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.655 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -40.77 84.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.456 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.868 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -64.82 -40.99 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.498 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -59.86 -35.33 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -49.2 74.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -69.25 -45.11 70.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.99 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.902 HG11 HD11 ' A' ' 452' ' ' LEU . 23.6 t -61.38 -32.3 52.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 110.542 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -56.66 -37.05 70.26 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.239 0.543 . . . . 0.0 109.861 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -86.73 -67.7 0.8 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.671 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.896 ' CD1' HD22 ' A' ' 412' ' ' LEU . 4.0 t80 58.92 142.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.142 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.596 ' O ' HG12 ' A' ' 401' ' ' VAL . 18.0 t -123.92 20.68 4.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.093 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.528 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -115.89 178.57 17.62 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.402 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.458 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -134.19 157.03 47.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.884 0.373 . . . . 0.0 111.603 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.604 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.5 -31.71 56.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.661 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.6 t -89.77 9.48 27.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.791 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.458 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 1.8 m-20 -115.09 164.81 13.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.336 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.731 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.8 mmtm -69.66 -29.87 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.482 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -62.54 -29.23 70.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.579 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.604 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 22.9 t80 -71.64 -45.89 60.68 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.129 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.731 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.9 OUTLIER -73.14 -31.59 64.37 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.716 177.653 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.3 tp -67.8 -38.41 83.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.046 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.896 HD22 ' CD1' ' A' ' 400' ' ' PHE . 21.3 tp -60.85 -47.28 87.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -70.67 -32.02 69.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.795 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.57 -46.21 86.95 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.008 -179.112 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.613 ' CE ' HD12 ' A' ' 412' ' ' LEU . 8.2 ptt? -64.49 -37.56 87.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.977 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.632 ' O ' HD12 ' A' ' 416' ' ' LEU . 5.0 tp -65.95 -37.19 85.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.253 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 29.8 m -62.53 -40.35 96.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.888 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -60.52 -47.31 86.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.854 0.359 . . . . 0.0 110.489 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.717 ' OE1' HD13 ' A' ' 393' ' ' LEU . 14.7 pt-20 -72.17 -35.83 69.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.2 0.524 . . . . 0.0 109.809 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 1.044 HD12 HD12 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -61.97 -39.56 92.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.979 179.162 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.574 ' N ' HD23 ' A' ' 420' ' ' LEU . 1.7 tp -70.72 -31.79 68.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.073 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.04 -46.52 89.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.193 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.9 HD13 ' HB3' ' A' ' 441' ' ' ALA . 4.0 pp -74.45 -30.97 62.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -98.81 30.95 3.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.859 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.2 t -108.25 -16.01 14.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 5.6 m -66.53 127.34 27.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.864 0.364 . . . . 0.0 111.123 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -84.79 -41.73 15.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.9 p 55.89 -174.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.021 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -178.05 50.64 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.22 -28.92 4.21 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.454 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.757 ' HG2' HG23 ' A' ' 434' ' ' VAL . 0.3 OUTLIER -60.17 92.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.31 -35.61 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 20.5 p -61.81 -38.71 89.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.757 HG23 ' HG2' ' A' ' 431' ' ' GLN . 31.0 t -76.07 -36.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.056 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -40.99 94.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.88 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -69.22 -36.69 77.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 1.019 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.21 -45.1 58.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.417 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 439' ' ' LYS . 0.0 OUTLIER -65.17 -39.77 93.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.936 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 439' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 438' ' ' ARG . 0.0 OUTLIER -63.99 -43.42 95.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.601 179.818 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -32.31 71.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.696 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.9 ' HB3' HD13 ' A' ' 423' ' ' LEU . . . -66.9 -45.45 77.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.194 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.617 ' HA ' HD11 ' A' ' 445' ' ' ILE . 23.2 t -62.89 -30.78 50.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.111 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 4.0 t -67.35 -40.64 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.917 0.389 . . . . 0.0 110.48 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -44.73 78.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.087 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 1.044 HD12 HD12 ' A' ' 420' ' ' LEU . 9.4 pt -65.35 -31.23 52.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.916 0.388 . . . . 0.0 110.873 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.18 -47.78 84.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.725 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.67 80.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.819 HD12 ' HA ' ' A' ' 445' ' ' ILE . 21.4 mt -66.88 -36.6 77.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.718 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.45 -51.52 69.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.675 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -61.93 -30.47 70.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 110.336 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.39 75.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.075 0.464 . . . . 0.0 109.992 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.902 HD11 HG11 ' A' ' 397' ' ' VAL . 4.9 mp -70.81 -36.8 73.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.287 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -56.16 -29.84 61.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.187 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -101.19 -16.57 16.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.544 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -22.23 35.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.709 0.29 . . . . 0.0 110.95 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.36 -86.39 0.61 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.381 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.881 179.943 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.518 -0.259 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.9 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.8 mm -58.65 -29.76 40.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 2.1 mmpt? -56.71 -32.97 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.103 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -66.1 -41.98 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.941 0.401 . . . . 0.0 111.529 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.9 HG22 ' O ' ' A' ' 380' ' ' ILE . 7.8 tp -60.57 -31.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.547 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.693 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.91 -44.82 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.696 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -58.56 -49.35 77.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.809 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.452 HG13 ' N ' ' A' ' 387' ' ' LEU . 11.9 p -64.1 -42.89 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.452 ' N ' HG13 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -65.56 -33.5 76.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.681 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.87 -34.82 78.18 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.947 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.15 -43.38 87.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.487 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.71 HG13 ' OE2' ' A' ' 419' ' ' GLU . 28.0 t -61.97 -35.97 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.853 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.01 -41.07 97.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.808 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -68.27 -42.2 79.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.77 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.81 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.3 mm? -61.26 -38.22 85.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.717 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -60.38 -45.64 92.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.724 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -60.94 -35.68 77.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.808 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -69.34 -39.93 77.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.006 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 393' ' ' LEU . 9.0 t -60.62 -39.71 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.842 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -40.31 72.04 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.435 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -76.88 -54.27 6.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.101 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.689 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.5 t80 -24.3 113.11 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.051 -0.977 . . . . 0.0 113.222 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.616 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.5 p -104.71 28.11 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.351 178.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.689 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -50.58 -179.96 0.03 OUTLIER Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.87 -0.605 . . . . 0.0 113.411 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.88 143.51 48.33 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.708 -0.746 . . . . 0.0 111.636 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -20.46 43.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.493 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.2 m -101.87 -14.33 17.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.751 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.5 ' OD2' ' HB3' ' A' ' 408' ' ' ALA . 23.7 t70 -77.47 151.44 34.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.786 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.9 OUTLIER -71.29 -32.02 68.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 179.788 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.5 ' HB3' ' OD2' ' A' ' 406' ' ' ASP . . . -62.89 -29.1 70.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.342 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.529 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 29.8 t80 -64.23 -45.4 88.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.797 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.786 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.3 p-90 -72.82 -27.84 62.2 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 118.826 -1.149 . . . . 0.0 108.677 177.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.568 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.3 mp -67.59 -41.37 84.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.521 177.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 1.019 HD12 HD11 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.35 -47.21 86.91 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.285 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.545 ' HG2' HD23 ' A' ' 449' ' ' LEU . 11.3 mt-10 -70.49 -32.37 69.85 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.483 177.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.83 -43.42 96.25 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.721 -179.676 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.739 ' CE ' HD11 ' A' ' 393' ' ' LEU . 18.7 ttt -69.66 -41.37 75.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.266 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.626 HD13 ' O ' ' A' ' 416' ' ' LEU . 0.4 OUTLIER -66.04 -37.21 85.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.721 179.637 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.435 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 85.0 m -67.71 -30.31 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.91 -38.4 72.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.441 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.71 ' OE2' HG13 ' A' ' 390' ' ' VAL . 5.4 pt-20 -70.78 -37.95 73.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.556 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.854 HD12 ' N ' ' A' ' 421' ' ' LEU . 4.2 pp -72.97 -33.32 65.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 110.851 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.854 ' N ' HD12 ' A' ' 420' ' ' LEU . 1.1 tp -68.49 -32.24 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -71.1 -39.48 72.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.793 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.691 HD13 ' HB1' ' A' ' 441' ' ' ALA . 3.0 mt -58.56 -31.74 68.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.833 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.13 -25.04 17.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.082 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 38.3 t -55.44 -31.02 61.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.023 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 7.6 m -74.68 120.87 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.109 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -88.4 143.15 27.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.411 HG21 ' CG1' ' A' ' 434' ' ' VAL . 27.1 p -131.23 -170.51 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.883 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -147.86 -90.58 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.516 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -96.45 29.76 9.79 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 89.82 4.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -40.05 96.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.809 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.3 t -60.0 -41.03 91.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.827 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.411 ' CG1' HG21 ' A' ' 428' ' ' THR . 32.1 t -71.4 -35.61 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.978 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 435' ' ' ARG . . . . . 0.434 ' HA ' ' HD3' ' A' ' 438' ' ' ARG . 0.1 OUTLIER -64.5 -43.54 93.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.716 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 436' ' ' GLN . . . . . 0.402 ' HA ' ' HG2' ' A' ' 439' ' ' LYS . 2.8 tt0 -69.19 -32.85 72.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.871 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.33 -45.13 61.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.863 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.434 ' HD3' ' HA ' ' A' ' 435' ' ' ARG . 14.5 ptm180 -64.12 -44.55 91.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.572 0.225 . . . . 0.0 111.333 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 439' ' ' LYS . . . . . 0.436 ' HG3' ' N ' ' A' ' 440' ' ' GLU . 1.5 pttt -63.72 -32.87 74.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.903 0.382 . . . . 0.0 110.576 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 440' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 4.7 mm-40 -67.75 -31.24 71.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.533 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.691 ' HB1' HD13 ' A' ' 423' ' ' LEU . . . -70.59 -40.2 73.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.798 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.561 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 21.2 t -62.86 -34.13 64.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 66.0 m -70.7 -43.52 68.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.732 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.87 -44.75 69.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.009 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.776 HD13 HD22 ' A' ' 420' ' ' LEU . 2.3 pp -63.89 -31.13 51.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.107 0.48 . . . . 0.0 110.697 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -39.88 90.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.341 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.56 81.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.055 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.801 ' CG2' HG21 ' A' ' 397' ' ' VAL . 19.3 mt -72.67 -38.33 58.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.545 HD23 ' HG2' ' A' ' 413' ' ' GLU . 3.5 mt -57.76 -48.52 79.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -70.18 -37.17 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.638 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.89 -31.27 66.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.082 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 1.019 HD11 HD12 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -76.23 -36.74 58.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.444 179.351 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.74 -29.91 65.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.602 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.11 -13.46 28.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.248 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.415 ' CE ' HG12 ' A' ' 397' ' ' VAL . 0.0 OUTLIER -82.42 -24.24 34.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.809 0.338 . . . . 0.0 110.6 179.82 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -79.11 -80.61 0.75 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.368 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.255 -0.878 . . . . 0.0 110.862 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 N--CA 1.462 0.143 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.916 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.4 mm -58.85 -30.09 41.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.229 0.538 . . . . 0.0 109.691 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 20.2 pttt -56.66 -33.01 65.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.932 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.648 ' O ' HG23 ' A' ' 386' ' ' VAL . 32.4 mttt -65.07 -42.96 93.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.589 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.916 HG22 ' O ' ' A' ' 380' ' ' ILE . 0.8 OUTLIER -60.57 -32.04 50.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.717 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.88 -44.76 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.545 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -56.69 -47.31 80.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.692 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 382' ' ' LYS . 37.2 t -65.43 -34.5 70.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.669 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.44 82.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.49 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 388' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 0.6 OUTLIER -62.73 -34.64 77.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.581 178.897 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 389' ' ' LYS . . . . . 0.803 ' O ' HD23 ' A' ' 393' ' ' LEU . 0.0 OUTLIER -70.16 -34.67 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.438 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 386' ' ' VAL . 28.2 t -67.08 -46.76 83.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 13.5 pt20 -60.36 -40.93 92.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -68.52 -38.77 81.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.302 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.84 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.6 mm? -64.91 -37.9 89.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.323 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 394' ' ' GLU . . . . . 0.407 ' HB2' HD11 ' A' ' 448' ' ' ILE . 4.5 tt0 -58.86 -44.0 90.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.457 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.5 -39.64 88.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.694 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -69.24 -40.05 78.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.908 HG21 HG21 ' A' ' 448' ' ' ILE . 23.7 t -60.63 -36.98 74.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.68 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -38.31 70.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.203 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.501 ' O ' ' C ' ' A' ' 400' ' ' PHE . 18.2 tt0 -79.84 -55.46 4.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.043 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.648 ' CE1' HD23 ' A' ' 412' ' ' LEU . 20.4 t80 -4.71 109.12 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.404 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 23.3 m -101.47 25.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.692 178.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.602 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -67.36 -173.59 6.53 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.843 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.0 143.74 48.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.305 -0.447 . . . . 0.0 111.496 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.455 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -57.27 -24.3 53.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.903 179.147 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 405' ' ' THR . . . . . 0.425 HG22 ' O ' ' A' ' 405' ' ' THR . 7.6 m -103.84 13.33 33.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.204 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.71 149.24 28.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.791 0.329 . . . . 0.0 110.687 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.782 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.16 -30.09 70.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.97 0.414 . . . . 0.0 110.9 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.78 -29.15 70.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.012 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 3.0 t80 -68.01 -45.56 73.68 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.782 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.13 63.84 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.691 177.798 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.577 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -66.44 -40.05 89.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.423 177.925 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -60.83 -47.25 87.21 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.117 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.544 ' HA ' HD21 ' A' ' 416' ' ' LEU . 0.9 OUTLIER -70.73 -32.27 69.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.729 177.811 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.85 -45.26 90.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.636 -179.165 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.502 ' HA ' ' HG2' ' A' ' 418' ' ' LYS . 21.4 ptp -66.45 -44.79 81.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.748 0.309 . . . . 0.0 111.136 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.676 HD12 ' N ' ' A' ' 417' ' ' THR . 4.1 pp -69.26 -37.13 77.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.831 0.348 . . . . 0.0 111.073 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.676 ' N ' HD12 ' A' ' 416' ' ' LEU . 98.5 m -73.61 -44.03 58.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.679 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 418' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -58.01 -37.96 75.25 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.599 -179.627 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.498 ' OE2' HG22 ' A' ' 390' ' ' VAL . 19.0 pt-20 -72.27 -34.8 68.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.206 0.527 . . . . 0.0 109.651 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.86 ' HA ' HD12 ' A' ' 423' ' ' LEU . 15.5 tp -65.98 -44.13 85.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.446 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.63 -34.07 75.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.78 -39.46 94.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.433 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.86 HD12 ' HA ' ' A' ' 420' ' ' LEU . 6.7 mt -60.21 -35.17 74.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.789 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.24 -28.85 57.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.061 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.3 m -57.01 -34.87 68.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.962 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.06 120.15 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.0 158.13 8.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.992 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.446 ' HA ' HG21 ' A' ' 434' ' ' VAL . 72.3 p -122.71 -72.69 0.67 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 71.9 -100.47 0.93 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.551 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -118.71 72.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.479 ' HB3' HG22 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -160.21 108.8 1.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.902 0.382 . . . . 0.0 110.823 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.57 -28.63 67.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.397 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.8 m -57.54 -44.97 85.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.685 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.479 HG22 ' HB3' ' A' ' 431' ' ' GLN . 17.2 m -76.11 -35.48 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.147 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -44.43 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.872 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -35.8 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.777 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.96 -32.13 65.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.99 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.537 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -72.72 -42.45 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.354 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 -36.64 84.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.567 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -42.57 99.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.81 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.523 ' CB ' HD13 ' A' ' 423' ' ' LEU . . . -62.07 -45.57 92.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.915 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.573 HG22 HD11 ' A' ' 420' ' ' LEU . 22.2 t -63.96 -31.64 54.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.909 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 97.9 m -70.7 -46.78 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.924 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -44.76 76.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.763 HG12 HD13 ' A' ' 420' ' ' LEU . 2.4 pp -64.14 -31.13 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.792 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -46.58 88.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.152 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -63.08 -36.03 82.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.684 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.908 HG21 HG21 ' A' ' 397' ' ' VAL . 17.6 mt -73.14 -36.54 50.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.806 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.49 -49.26 76.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.702 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -41.87 66.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.416 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.9 mmtp -57.88 -30.01 65.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.083 0.468 . . . . 0.0 110.007 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.462 HD12 HG13 ' A' ' 397' ' ' VAL . 1.8 tp -76.72 -36.72 56.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.438 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -56.98 -29.9 63.65 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -96.52 -11.16 25.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.477 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.56 -24.69 33.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -94.66 -71.34 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.416 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.401 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.935 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.518 -0.26 0 CA-C-O 120.697 0.284 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.654 HG22 HD11 ' A' ' 384' ' ' ILE . 3.2 mt -58.71 -29.77 40.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.371 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -56.8 -33.17 66.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.978 -179.815 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -67.48 -38.03 83.77 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.135 0.493 . . . . 0.0 110.745 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 40.8 mm -60.44 -33.58 54.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.63 178.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.654 HD11 HG22 ' A' ' 380' ' ' ILE . 0.4 OUTLIER -74.74 -44.41 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.411 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.57 -45.12 81.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.062 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 382' ' ' LYS . 57.8 t -66.13 -39.63 84.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.162 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.681 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.58 -32.57 73.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.292 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -35.14 79.18 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -38.06 74.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.184 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.681 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.9 p -70.38 -37.7 71.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.582 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -66.9 -40.97 87.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.841 0.353 . . . . 0.0 110.624 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -40.75 75.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.468 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.898 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.7 OUTLIER -62.04 -38.65 89.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.426 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -59.63 -47.32 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.676 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -36.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.659 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -69.32 -37.5 77.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.096 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 393' ' ' LEU . 25.6 t -60.53 -45.64 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.218 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -55.49 -31.92 62.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.915 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -87.4 -54.39 4.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.52 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.799 ' CE2' HD22 ' A' ' 412' ' ' LEU . 4.1 t80 -48.11 113.54 0.76 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.741 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.468 ' O ' ' O ' ' A' ' 402' ' ' GLY . 28.7 m -47.68 -31.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.881 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.689 ' HA2' ' CZ ' ' A' ' 400' ' ' PHE . . . 37.4 106.7 0.01 OUTLIER Glycine 0 C--O 1.228 -0.264 0 N-CA-C 114.679 0.632 . . . . 0.0 114.679 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.25 143.0 48.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.039 0.447 . . . . 0.0 110.893 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.487 ' HG2' ' CB ' ' A' ' 457' ' ' LEU . 0.2 OUTLIER -60.09 -22.18 62.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.217 179.764 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.99 1.1 51.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.35 135.64 53.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.917 0.389 . . . . 0.0 110.564 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.706 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 10.9 mtmt -61.01 -29.87 69.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.641 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 412' ' ' LEU . . . -62.71 -28.97 70.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.054 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 38.5 t80 -67.23 -45.85 75.55 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.706 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -73.05 -30.27 63.59 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 118.824 -1.15 . . . . 0.0 108.934 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.579 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.0 tp -69.63 -38.45 77.22 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.743 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 1.044 HD23 HD11 ' A' ' 452' ' ' LEU . 0.3 OUTLIER -62.31 -47.16 85.49 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -70.64 -32.81 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.408 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.1 mt-10 -64.1 -43.6 94.85 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.824 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 39.2 ttm -69.59 -35.26 75.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.659 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 11.3 tp -63.41 -48.08 79.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.818 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 52.7 m -65.01 -30.46 71.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.066 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -47.34 85.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.259 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.45 ' OE2' HG23 ' A' ' 390' ' ' VAL . 2.9 pt-20 -67.21 -36.16 81.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.577 HD13 ' C ' ' A' ' 420' ' ' LEU . 3.1 tm? -67.74 -34.64 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.001 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.22 -31.9 69.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -43.0 98.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.772 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 438' ' ' ARG . 0.2 OUTLIER -54.79 -31.15 58.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.014 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -76.64 -14.19 60.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 5.8 m -84.58 -25.79 28.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.768 0.318 . . . . 0.0 111.143 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.6 137.73 24.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.167 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.9 164.55 25.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.541 HG21 HH11 ' A' ' 438' ' ' ARG . 2.0 t -178.48 126.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.71 -84.97 1.78 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.439 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.89 38.09 1.86 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.473 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.559 ' HB3' HG22 ' A' ' 434' ' ' VAL . 0.5 OUTLIER -91.77 123.82 35.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 110.892 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -67.69 -28.65 67.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.076 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.6 t -67.17 -44.85 78.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.675 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.559 HG22 ' HB3' ' A' ' 431' ' ' GLN . 21.4 m -75.47 -37.59 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.733 0.301 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 40.1 mtt180 -67.66 -44.65 77.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.911 0.386 . . . . 0.0 110.697 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -69.41 -34.46 74.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.94 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.24 -45.22 57.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.513 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.541 HH11 HG21 ' A' ' 428' ' ' THR . 0.9 OUTLIER -65.06 -39.12 92.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.781 0.324 . . . . 0.0 110.884 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -35.21 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.529 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.38 -35.89 80.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.441 ' CB ' HD13 ' A' ' 423' ' ' LEU . . . -62.09 -45.43 93.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.548 HG22 HD21 ' A' ' 420' ' ' LEU . 24.3 t -62.96 -33.29 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.752 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.2 m -70.73 -45.23 65.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.506 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -44.65 77.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.062 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.618 HD12 ' N ' ' A' ' 446' ' ' GLN . 2.8 pp -63.37 -31.03 51.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.618 ' N ' HD12 ' A' ' 445' ' ' ILE . 5.6 tp-100 -65.1 -41.54 94.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.508 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.49 -40.2 92.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.401 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.6 mt -67.7 -36.66 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -46.99 83.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.698 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -40.58 68.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.536 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -30.6 66.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.025 0.44 . . . . 0.0 109.967 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 1.044 HD11 HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -77.59 -36.76 51.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.264 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.5 -29.94 69.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.629 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -86.64 -18.8 30.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.427 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 402' ' ' GLY . 0.0 OUTLIER -82.25 -25.93 33.65 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.828 ' O ' HD12 ' A' ' 457' ' ' LEU . . . -130.42 -115.96 1.8 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.828 HD12 ' O ' ' A' ' 456' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.03 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 66.0 m . . . . . 0 CA--C 1.52 -0.179 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.686 HG22 HD11 ' A' ' 384' ' ' ILE . 43.8 mm -58.63 -29.77 40.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.474 ' HA ' HG12 ' A' ' 384' ' ' ILE . 27.3 mtmm -56.92 -33.16 66.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.06 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -67.92 -37.97 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.133 0.492 . . . . 0.0 110.694 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.877 HG21 ' HB1' ' A' ' 437' ' ' ALA . 37.5 mt -60.55 -33.6 55.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.41 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.686 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.77 -44.65 45.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.237 178.477 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -49.38 77.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.669 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.724 HG21 ' HB3' ' A' ' 423' ' ' LEU . 14.5 p -65.47 -45.02 94.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.494 ' N ' HG13 ' A' ' 386' ' ' VAL . 5.3 tt -63.38 -33.41 75.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.8 -35.05 78.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.741 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.38 -40.26 93.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.286 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.86 HG22 ' OE2' ' A' ' 419' ' ' GLU . 24.6 t -64.35 -37.01 78.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 -41.15 89.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -63.42 -38.52 91.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.455 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.802 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -63.77 -38.03 89.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 179.544 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.93 -42.79 90.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.639 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.95 -40.3 92.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -69.12 -45.26 70.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.777 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 393' ' ' LEU . 23.1 t -60.65 -36.91 73.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.705 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -58.42 -40.36 82.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.101 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -84.16 -67.55 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.809 ' CD1' HD22 ' A' ' 412' ' ' LEU . 18.6 t80 21.96 107.83 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 401' ' ' VAL . 20.4 t -95.79 25.93 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.065 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.583 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -84.88 -176.8 50.95 Favored Glycine 0 N--CA 1.441 -0.99 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.732 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.25 143.81 48.02 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.404 -0.398 . . . . 0.0 111.628 -179.73 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.492 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -58.6 -23.52 58.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.82 0.343 . . . . 0.0 110.867 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 405' ' ' THR . . . . . 0.414 HG22 ' HD2' ' A' ' 404' ' ' LYS . 16.1 p -101.99 12.96 36.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.104 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.64 153.5 26.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.8 0.334 . . . . 0.0 110.873 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.819 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.2 mttt -61.15 -30.1 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.899 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.73 -29.19 70.49 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.508 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.492 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 3.7 t80 -72.06 -45.67 59.86 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.343 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.819 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -73.07 -29.36 62.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 118.841 -1.144 . . . . 0.0 108.9 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 15.8 tp -69.68 -41.32 75.61 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.428 178.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.809 HD22 ' CD1' ' A' ' 400' ' ' PHE . 8.0 tp -61.07 -46.71 89.56 Favored 'General case' 0 C--N 1.34 0.168 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.454 ' HG2' HD11 ' A' ' 416' ' ' LEU . 1.1 tt0 -70.2 -32.16 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.602 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.5 OUTLIER -63.9 -37.78 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.83 -179.652 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 5.9 ttt -69.75 -44.57 69.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.173 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.847 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -68.88 -37.01 78.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.791 0.329 . . . . 0.0 110.843 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.847 ' N ' HD12 ' A' ' 416' ' ' LEU . 90.4 m -62.58 -33.57 75.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.493 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -66.35 -47.46 73.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.138 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.86 ' OE2' HG22 ' A' ' 390' ' ' VAL . 0.3 OUTLIER -69.77 -34.7 74.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.804 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.82 HD12 ' CG2' ' A' ' 445' ' ' ILE . 6.2 tt -59.6 -44.42 93.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.864 178.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' A' ' 421' ' ' LEU . 1.7 tp -70.51 -31.82 69.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.354 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.67 -46.88 87.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.427 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.777 HD21 HD11 ' A' ' 445' ' ' ILE . 1.7 pp -74.55 -31.06 61.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.797 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.78 -19.46 61.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.116 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 35.5 t -95.3 35.38 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.197 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 426' ' ' VAL . . . . . 0.449 HG13 ' O ' ' A' ' 423' ' ' LEU . 34.1 m -97.78 131.92 43.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -91.85 128.15 37.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.1 t -113.94 145.31 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.92 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.29 66.46 0.55 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.439 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.35 74.49 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.495 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.468 ' OE1' HG21 ' A' ' 434' ' ' VAL . 86.1 mt-30 -97.22 114.03 25.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 0.0 110.844 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.79 -31.58 72.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 18.5 t -63.48 -44.42 94.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.468 HG21 ' OE1' ' A' ' 431' ' ' GLN . 21.8 t -68.47 -38.94 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.116 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -44.61 96.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.884 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -69.23 -35.64 76.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.851 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 0.877 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.19 -37.02 66.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.181 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.73 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.3 OUTLIER -72.7 -44.69 61.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 -179.809 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -34.09 75.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.879 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.13 -41.76 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -63.75 -45.73 88.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.339 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 438' ' ' ARG . 34.0 t -63.82 -32.81 58.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.873 0.368 . . . . 0.0 110.854 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.88 -43.57 98.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.588 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.21 -37.78 88.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.82 ' CG2' HD12 ' A' ' 420' ' ' LEU . 14.7 mt -63.26 -33.21 59.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.106 0.479 . . . . 0.0 110.575 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.22 -47.72 83.19 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.752 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.58 70.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.862 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.788 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.6 mt -62.52 -37.07 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.643 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -52.93 63.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.647 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -39.53 86.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.525 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.4 ttpp -57.89 -30.12 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.209 0.528 . . . . 0.0 109.729 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' A' ' 400' ' ' PHE . 36.4 tp -72.82 -36.43 67.53 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.416 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.91 -29.9 60.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.221 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.36 -22.8 32.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.198 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.37 -21.89 35.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -69.07 -99.98 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.401 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.923 179.968 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 24.0 m . . . . . 0 CA--C 1.519 -0.225 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.735 ' HA ' HD12 ' A' ' 383' ' ' ILE . 31.3 mm -58.71 -29.87 40.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.461 ' HA ' HG12 ' A' ' 384' ' ' ILE . 15.2 mtmt -56.96 -33.26 66.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.82 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.455 ' O ' HG12 ' A' ' 386' ' ' VAL . 4.1 mttt -67.62 -38.02 83.33 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.128 0.489 . . . . 0.0 110.763 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.738 HG21 ' HB1' ' A' ' 437' ' ' ALA . 24.8 mt -60.48 -34.01 56.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.449 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.643 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.66 -44.78 46.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.204 178.445 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -48.53 81.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.468 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.497 HG13 ' N ' ' A' ' 387' ' ' LEU . 14.5 p -67.45 -45.88 84.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.497 ' N ' HG13 ' A' ' 386' ' ' VAL . 6.5 tt -64.59 -33.62 76.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.378 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -62.68 -35.06 78.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.704 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -39.18 91.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.1 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.867 HG13 ' OE2' ' A' ' 419' ' ' GLU . 40.5 t -66.81 -36.03 76.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.413 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -40.97 85.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.582 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -48.0 76.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.47 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.811 HD22 HD23 ' A' ' 416' ' ' LEU . 4.9 tt -60.88 -38.09 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.406 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -39.32 83.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.379 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -61.48 -40.51 94.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.427 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -68.11 -40.89 82.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.638 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.728 HG23 ' O ' ' A' ' 393' ' ' LEU . 22.0 t -60.67 -30.5 47.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.693 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -61.99 -36.82 82.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.188 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -87.48 -67.75 0.8 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.215 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.951 ' CD1' HD22 ' A' ' 412' ' ' LEU . 5.5 t80 56.13 159.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.423 0.63 . . . . 0.0 111.915 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 m -142.26 20.49 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.056 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.563 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -108.18 -172.68 21.7 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.799 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.442 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.08 144.53 48.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.718 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.554 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.77 -28.6 15.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.124 179.238 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.7 t -102.68 15.89 28.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -115.44 157.69 23.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.92 0.39 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.831 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.8 tmtt? -61.18 -30.09 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.963 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.85 -29.13 70.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.632 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.554 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 11.0 t80 -75.18 -45.9 37.64 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.831 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -73.1 -31.99 64.69 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.68 -1.208 . . . . 0.0 108.61 177.779 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.607 HD11 ' CE ' ' A' ' 415' ' ' MET . 38.7 tp -65.67 -41.11 92.84 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.093 177.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.956 HD23 HD21 ' A' ' 452' ' ' LEU . 30.4 tp -59.66 -46.73 88.14 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.18 -31.72 69.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.773 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.9 tm-20 -63.28 -43.39 98.04 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.983 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.607 ' CE ' HD11 ' A' ' 411' ' ' LEU . 9.7 mmt -67.06 -40.18 87.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 109.664 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.811 HD23 HD22 ' A' ' 393' ' ' LEU . 1.2 tm? -61.11 -37.36 82.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.645 179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 3.6 m -62.84 -42.18 99.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.884 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -47.22 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.844 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.867 ' OE2' HG13 ' A' ' 390' ' ' VAL . 3.9 pt-20 -70.85 -34.78 72.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.372 . . . . 0.0 110.125 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 1.042 HD11 HD13 ' A' ' 445' ' ' ILE . 1.2 tt -61.61 -45.1 95.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.122 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 421' ' ' LEU . 3.4 tp -70.21 -31.88 69.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.785 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -58.9 -46.29 88.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.837 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 419' ' ' GLU . 1.2 mt -59.54 -31.42 69.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.806 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -100.47 29.18 4.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.913 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 57.6 m -107.96 -29.22 9.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 15.0 m -66.54 133.5 31.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.08 166.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.498 ' HB ' HG11 ' A' ' 434' ' ' VAL . 1.8 t -156.67 -45.84 0.07 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.914 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 75.01 -69.28 1.9 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.444 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -164.5 40.71 0.3 Allowed Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.425 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -96.38 119.56 35.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -63.11 -31.45 72.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.859 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.7 m -67.65 -42.38 82.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.939 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.498 HG11 ' HB ' ' A' ' 428' ' ' THR . 26.2 t -73.44 -43.46 55.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 435' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 438' ' ' ARG . 4.7 mtt180 -59.21 -40.64 86.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.752 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -69.4 -34.58 74.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.892 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 0.738 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -71.77 -45.34 61.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.634 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 435' ' ' ARG . 0.2 OUTLIER -66.33 -35.06 79.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.389 . . . . 0.0 110.602 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -34.25 77.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -67.33 -37.0 82.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.76 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.478 ' HB1' HD13 ' A' ' 423' ' ' LEU . . . -61.95 -45.53 93.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.058 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.543 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 31.5 t -63.32 -32.76 57.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.788 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -46.79 62.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.023 0.44 . . . . 0.0 110.815 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.73 88.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.046 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 1.042 HD13 HD11 ' A' ' 420' ' ' LEU . 1.9 pp -63.37 -31.15 51.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.99 0.424 . . . . 0.0 110.609 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.32 -47.7 84.89 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.837 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.74 -35.85 79.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.466 HD12 ' HA ' ' A' ' 445' ' ' ILE . 41.6 mt -70.16 -36.4 67.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.861 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -48.33 79.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.72 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -39.71 91.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.24 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -57.77 -30.1 65.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.166 0.508 . . . . 0.0 109.692 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.956 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -72.08 -37.28 69.64 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.378 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -58.07 -29.91 65.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.63 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 454' ' ' LYS . . . . . 0.402 ' O ' HD13 ' A' ' 457' ' ' LEU . 7.8 mtmt -91.01 -15.07 30.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.485 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -24.41 34.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.884 0.373 . . . . 0.0 110.583 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.32 -86.58 0.35 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.262 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 454' ' ' LYS . 3.8 mp . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.774 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.465 0.32 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.59 HG22 HD11 ' A' ' 384' ' ' ILE . 24.8 mm -58.62 -29.38 39.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.458 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.55 -33.31 66.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.008 -179.715 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -68.24 -38.09 81.48 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.224 0.535 . . . . 0.0 110.65 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.748 HD11 HG13 ' A' ' 434' ' ' VAL . 47.7 mt -60.49 -33.97 56.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.531 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.59 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.78 -44.63 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.348 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -56.8 -48.44 77.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.323 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.749 HG21 ' HG ' ' A' ' 423' ' ' LEU . 13.5 p -66.41 -36.3 77.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.652 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.34 -35.93 80.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.43 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.79 -34.95 78.33 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -34.65 72.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.54 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 386' ' ' VAL . 21.4 t -70.4 -46.17 71.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.283 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -58.32 -38.8 77.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.683 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.78 -43.42 98.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.895 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -59.78 -38.55 82.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.47 179.531 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 394' ' ' GLU . . . . . 0.426 ' HG3' HD11 ' A' ' 448' ' ' ILE . 0.2 OUTLIER -59.01 -39.88 83.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.602 179.751 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -45.39 92.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.637 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -69.29 -44.26 72.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.76 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 393' ' ' LEU . 28.0 t -60.61 -31.38 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.507 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -60.38 -36.37 77.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.206 0.527 . . . . 0.0 109.928 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.48 ' O ' ' O ' ' A' ' 400' ' ' PHE . 5.2 tt0 -90.73 -69.03 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.926 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.776 ' CD1' HD22 ' A' ' 412' ' ' LEU . 10.2 t80 36.47 109.0 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.118 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 27.8 m -94.81 25.44 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.107 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.528 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.07 -174.46 43.83 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.707 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.81 143.61 48.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.574 -0.313 . . . . 0.0 111.413 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.531 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -56.69 -23.71 44.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.549 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.68 10.15 36.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.308 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.47 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 0.1 OUTLIER -101.93 150.58 23.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.841 0.353 . . . . 0.0 110.474 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.794 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 pptp? -61.13 -30.2 70.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.85 -29.23 70.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.24 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.531 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.6 t80 -69.69 -45.6 67.91 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.794 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 5.5 p-90 -72.87 -30.53 64.05 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.902 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.608 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 26.0 tp -69.69 -38.43 77.01 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.418 177.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.776 HD22 ' CD1' ' A' ' 400' ' ' PHE . 9.7 tp -61.53 -47.19 86.72 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.662 ' HG3' HD13 ' A' ' 452' ' ' LEU . 2.0 mt-10 -70.5 -32.52 70.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.483 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.608 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mm-40 -65.51 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.001 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.67 -44.49 70.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.025 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.769 HD12 ' N ' ' A' ' 417' ' ' THR . 4.3 pp -68.86 -37.05 78.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.782 0.325 . . . . 0.0 110.734 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.769 ' N ' HD12 ' A' ' 416' ' ' LEU . 59.7 m -64.15 -38.97 92.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.621 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -47.28 86.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.459 ' CD ' HD12 ' A' ' 393' ' ' LEU . 14.8 pt-20 -68.53 -34.75 76.42 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.929 ' HB2' HD13 ' A' ' 445' ' ' ILE . 0.3 OUTLIER -60.79 -40.88 94.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.048 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.405 ' HA ' HD12 ' A' ' 421' ' ' LEU . 3.3 tp -69.4 -31.83 70.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.824 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.54 -38.32 87.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.749 ' HG ' HG21 ' A' ' 386' ' ' VAL . 0.3 OUTLIER -58.82 -31.23 68.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.792 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.83 27.8 5.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.5 t -100.11 -29.75 12.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 4.3 m -93.77 123.79 46.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 154.58 22.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.985 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 88.4 m -111.19 -64.39 1.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 108.89 -121.9 6.37 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.442 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -106.01 36.14 4.59 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.395 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -106.9 100.19 9.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.835 0.35 . . . . 0.0 110.921 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.14 -33.93 76.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 4.1 t -60.99 -44.83 96.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.748 HG13 HD11 ' A' ' 383' ' ' ILE . 28.9 t -70.31 -42.45 78.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.152 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -59.62 -40.69 88.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.827 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.31 -41.78 98.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.05 89.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.978 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.81 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -66.67 -44.51 81.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.759 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -67.95 -39.73 83.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.682 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -71.19 -36.57 71.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.781 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.73 -45.54 82.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.001 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.916 ' HA ' HD12 ' A' ' 445' ' ' ILE . 38.6 t -64.58 -33.05 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.024 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 9.4 m -60.89 -43.98 97.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.17 -36.31 83.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.332 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.929 HD13 ' HB2' ' A' ' 420' ' ' LEU . 30.0 mt -63.93 -31.23 52.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -42.54 83.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.145 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.83 78.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.726 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.544 ' CG2' HG21 ' A' ' 397' ' ' VAL . 45.2 mt -65.07 -36.46 77.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.712 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -54.3 48.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.867 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -42.12 88.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.393 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -29.96 65.37 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.762 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -68.73 -38.24 80.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.289 179.152 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.77 -29.85 65.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.896 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.92 -23.57 25.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.221 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -20.06 37.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.775 0.321 . . . . 0.0 110.734 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -67.85 -86.73 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.026 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.489 HD23 ' HG2' ' A' ' 404' ' ' LYS . 1.1 pp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.894 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 120.588 0.232 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.626 HG22 HD11 ' A' ' 384' ' ' ILE . 42.5 mm -58.72 -29.66 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 16.9 mttt -56.74 -33.12 66.24 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.599 ' O ' HG23 ' A' ' 386' ' ' VAL . 24.3 mtmt -66.41 -38.04 86.56 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.204 0.526 . . . . 0.0 110.694 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 54.5 mt -60.5 -34.76 59.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.398 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.626 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.96 -44.58 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.224 178.392 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -56.65 -37.39 70.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.398 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 382' ' ' LYS . 68.5 t -73.52 -40.69 55.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.484 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.637 ' O ' HG12 ' A' ' 390' ' ' VAL . 1.2 tt -67.57 -37.54 82.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.327 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.94 -34.93 78.51 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -44.48 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.083 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.5 p -63.18 -41.19 91.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.426 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.4 ' HG3' ' N ' ' A' ' 392' ' ' TYR . 11.9 pt20 -63.28 -37.95 89.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.991 0.424 . . . . 0.0 110.433 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 392' ' ' TYR . . . . . 0.4 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 1.8 m-85 -72.47 -39.83 67.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.427 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.797 HD11 ' HG2' ' A' ' 415' ' ' MET . 0.3 OUTLIER -62.11 -42.48 99.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.89 92.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.713 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -62.21 -35.37 78.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.662 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.28 -42.43 75.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.826 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.784 HG23 ' O ' ' A' ' 393' ' ' LEU . 14.5 t -60.66 -32.45 51.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.666 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -61.2 -36.16 79.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.96 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.503 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.9 tt0 -91.78 -68.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.993 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.858 ' CE1' HD13 ' A' ' 412' ' ' LEU . 6.6 t80 45.02 -84.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.714 -0.675 . . . . 0.0 112.611 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 399' ' ' GLU . 5.7 t 78.35 28.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.508 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -98.57 -150.76 26.35 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.501 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.624 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.44 171.09 14.54 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 120.439 0.162 . . . . 0.0 110.598 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.46 ' HD2' HG23 ' A' ' 405' ' ' THR . 0.0 OUTLIER -91.0 -10.17 43.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.58 0.228 . . . . 0.0 111.155 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 405' ' ' THR . . . . . 0.46 HG23 ' HD2' ' A' ' 404' ' ' LYS . 30.8 p -115.73 -15.55 11.32 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.498 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 18.2 t70 -61.54 162.37 8.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.887 0.375 . . . . 0.0 111.341 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.736 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.36 -38.42 71.57 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.627 179.671 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.418 ' HA ' ' HB2' ' A' ' 411' ' ' LEU . . . -62.69 -29.02 70.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.655 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.624 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 60.4 t80 -57.5 -45.4 84.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.926 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.736 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.58 -29.44 63.53 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 118.865 -1.134 . . . . 0.0 108.663 178.15 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -65.16 -39.34 92.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.356 177.835 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.858 HD13 ' CE1' ' A' ' 400' ' ' PHE . 8.3 tp -61.42 -47.04 87.58 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 30.6 tt0 -70.49 -32.27 69.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.688 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.563 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -64.02 -39.8 94.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.137 -179.426 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.797 ' HG2' HD11 ' A' ' 393' ' ' LEU . 41.2 ttm -69.74 -44.68 69.77 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.292 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 417' ' ' THR . 4.0 pp -68.75 -38.54 80.18 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.766 0.317 . . . . 0.0 110.683 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.78 ' N ' HD12 ' A' ' 416' ' ' LEU . 84.8 m -64.32 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.194 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 418' ' ' LYS . . . . . 0.631 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -66.01 -42.36 89.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.294 179.509 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.59 -36.65 68.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.318 0.58 . . . . 0.0 110.038 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.839 ' HG ' HG13 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -67.77 -49.26 63.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.833 -179.361 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.982 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -69.74 -31.53 69.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.138 -0.225 . . . . 0.0 111.355 -178.992 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 422' ' ' GLU . . . . . 0.982 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -61.09 -46.55 90.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.842 0.353 . . . . 0.0 110.791 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.805 HD22 ' HA ' ' A' ' 438' ' ' ARG . 4.2 mt -69.8 -31.0 68.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.061 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -82.41 0.5 41.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.414 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.11 -42.64 8.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 110.945 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.4 t -66.97 136.21 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.216 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -112.6 -178.45 3.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -138.68 160.92 38.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.854 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -126.96 43.34 1.35 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.481 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 136.77 -28.45 2.85 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.495 ' HB3' HG23 ' A' ' 434' ' ' VAL . 72.8 mt-30 -76.95 96.36 4.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.881 0.372 . . . . 0.0 110.905 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.21 -30.06 69.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.982 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -42.93 89.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.962 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.495 HG23 ' HB3' ' A' ' 431' ' ' GLN . 31.2 t -62.78 -35.63 71.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -65.54 -43.81 88.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.12 -32.88 72.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.144 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -68.61 -45.17 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.417 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.806 ' O ' HG23 ' A' ' 442' ' ' VAL . 11.1 ptt85 -72.63 -44.53 61.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.127 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -63.01 -34.61 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.836 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.12 -39.71 65.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.79 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.787 ' HB3' HD13 ' A' ' 423' ' ' LEU . . . -71.01 -45.57 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.1 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.839 HG13 ' HG ' ' A' ' 420' ' ' LEU . 46.9 t -62.86 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.959 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 11.8 t -60.9 -35.55 76.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.68 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.55 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.823 HD12 ' CA ' ' A' ' 420' ' ' LEU . 1.1 mt -65.52 -31.24 52.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -43.95 97.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.127 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.41 86.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.608 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.745 ' CG2' HG21 ' A' ' 397' ' ' VAL . 43.9 mt -67.43 -36.39 76.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.842 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.3 tt -57.35 -47.48 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.888 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -41.35 98.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.804 0.335 . . . . 0.0 110.125 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -30.13 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.778 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -67.15 -38.42 85.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.378 179.044 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.37 -29.89 62.01 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -89.7 -20.08 24.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.402 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -20.29 36.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.006 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.43 -81.55 0.45 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.469 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.955 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.748 HG22 HD11 ' A' ' 384' ' ' ILE . 1.6 mp -58.74 -28.82 38.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.514 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -55.78 -33.11 64.06 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.973 -179.055 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.646 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -66.98 -37.99 85.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.211 0.529 . . . . 0.0 110.617 179.586 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.922 HG21 ' HB1' ' A' ' 437' ' ' ALA . 39.4 mm -60.54 -34.42 58.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.577 178.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.748 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.78 -44.39 45.84 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.608 178.62 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -56.42 -42.55 78.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.836 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.684 ' O ' HG23 ' A' ' 390' ' ' VAL . 38.4 t -70.85 -36.65 65.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.914 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.402 HD21 ' NZ ' ' A' ' 444' ' ' LYS . 0.2 OUTLIER -67.66 -36.05 80.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.157 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -35.1 78.69 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -34.61 73.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.81 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.703 HG22 ' HB3' ' A' ' 419' ' ' GLU . 25.7 t -74.85 -35.82 37.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.312 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -58.37 -41.01 83.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.581 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.28 -41.81 76.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.05 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.761 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -65.39 -37.94 88.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.328 179.384 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -60.9 -41.15 95.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -39.79 88.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.37 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -68.76 -39.17 80.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.524 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 393' ' ' LEU . 35.2 t -60.71 -34.46 58.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.605 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -59.02 -40.24 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.989 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.8 tt0 -86.7 -68.23 0.76 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.823 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.868 ' CE1' HD13 ' A' ' 412' ' ' LEU . 4.7 t80 52.42 -80.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.454 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 401' ' ' VAL . 17.3 t 74.32 29.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.32 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -101.86 -151.38 24.17 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.654 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.64 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.4 OUTLIER -133.46 171.13 14.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.559 0.219 . . . . 0.0 110.732 -179.853 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.487 ' HA ' ' CD1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -91.98 -8.89 44.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.072 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.81 -14.58 11.34 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.484 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 33.8 t70 -63.62 163.05 11.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.913 0.387 . . . . 0.0 111.405 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.743 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.2 OUTLIER -71.52 -38.09 71.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.349 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.69 -28.94 70.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.622 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.64 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 58.4 t80 -58.26 -45.51 87.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.051 -179.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.743 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.64 -30.75 64.57 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 118.92 -1.112 . . . . 0.0 108.658 178.165 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 8.6 tp -64.73 -39.54 93.81 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.135 177.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.868 HD13 ' CE1' ' A' ' 400' ' ' PHE . 7.0 tp -60.48 -46.96 88.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -70.35 -32.2 69.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.9 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.6 -43.25 97.46 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.955 -179.249 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -69.44 -34.9 75.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.279 0.561 . . . . 0.0 110.1 179.143 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.761 HD11 ' HB ' ' A' ' 445' ' ' ILE . 1.8 tm? -60.42 -40.81 92.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.04 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.738 HG22 HD13 ' A' ' 421' ' ' LEU . 1.8 m -71.71 -32.46 67.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.006 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -47.11 84.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.539 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.703 ' HB3' HG22 ' A' ' 390' ' ' VAL . 8.8 mm-40 -63.58 -43.03 98.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.121 0.486 . . . . 0.0 109.703 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.637 HD11 HG22 ' A' ' 442' ' ' VAL . 2.8 tp -62.06 -43.59 98.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.14 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.738 HD13 HG22 ' A' ' 417' ' ' THR . 4.9 mp -61.78 -31.85 72.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.95 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -71.06 -37.14 72.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.741 HD22 ' CB ' ' A' ' 441' ' ' ALA . 0.5 OUTLIER -67.79 -31.02 70.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.925 179.915 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.16 -8.17 55.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.54 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.8 t -53.44 -30.13 38.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.802 0.334 . . . . 0.0 111.169 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 426' ' ' VAL . . . . . 0.579 HG11 HD11 ' A' ' 383' ' ' ILE . 12.1 m -70.79 131.18 34.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -85.58 -30.27 23.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.959 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.706 HG23 ' HB ' ' A' ' 434' ' ' VAL . 16.6 m 61.69 157.62 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.831 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -143.73 60.6 0.52 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.575 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 70.39 28.99 70.47 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.462 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -106.43 117.7 34.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.869 0.366 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.33 -31.44 70.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.85 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.0 t -60.31 -44.8 95.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.842 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.706 ' HB ' HG23 ' A' ' 428' ' ' THR . 26.5 t -75.44 -40.88 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -61.66 -40.99 96.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -34.82 75.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 0.922 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -67.25 -45.03 77.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.202 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 442' ' ' VAL . 7.2 ptm180 -71.15 -41.12 70.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.933 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 13.4 ttpt -62.2 -31.53 72.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.762 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -72.24 -37.6 69.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.731 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.741 ' CB ' HD22 ' A' ' 423' ' ' LEU . . . -66.64 -45.58 78.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.096 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.637 HG22 HD11 ' A' ' 420' ' ' LEU . 20.1 t -71.73 -30.74 39.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 46.8 t -70.71 -46.72 62.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.977 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 444' ' ' LYS . . . . . 0.402 ' NZ ' HD21 ' A' ' 387' ' ' LEU . 0.3 OUTLIER -68.11 -44.72 75.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.028 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.761 ' HB ' HD11 ' A' ' 416' ' ' LEU . 2.7 pp -63.35 -31.12 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.462 . . . . 0.0 110.771 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.465 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -63.41 -45.76 89.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.271 179.64 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.89 -34.19 74.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.536 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 445' ' ' ILE . 17.1 mt -74.75 -36.48 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.723 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 449' ' ' LEU . 0.2 OUTLIER -57.51 -53.87 53.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.861 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -61.46 -44.08 97.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.823 0.344 . . . . 0.0 110.342 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -29.75 65.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.753 HD21 HD23 ' A' ' 412' ' ' LEU . 0.5 OUTLIER -71.88 -40.04 69.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.803 179.479 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 453' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 454' ' ' LYS . 0.0 OUTLIER -64.28 -29.84 70.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.786 0.327 . . . . 0.0 110.841 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 454' ' ' LYS . . . . . 0.438 ' N ' ' HG3' ' A' ' 453' ' ' GLU . 0.3 OUTLIER -91.6 -13.96 31.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.301 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -82.51 -25.7 33.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.976 0.417 . . . . 0.0 110.465 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -72.66 -64.05 2.7 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.263 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.163 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 379' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 382' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.162 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.781 ' HA ' HD12 ' A' ' 383' ' ' ILE . 1.1 mm -58.74 -29.55 40.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.574 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.474 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.57 -33.22 65.95 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.631 -179.344 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.522 ' HG3' ' N ' ' A' ' 383' ' ' ILE . 0.1 OUTLIER -68.35 -37.63 80.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.077 0.465 . . . . 0.0 110.732 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 380' ' ' ILE . 16.2 mt -60.97 -34.06 58.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.482 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.474 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.97 -44.64 44.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.225 178.526 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -56.49 -47.57 78.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.334 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.582 ' O ' HG23 ' A' ' 390' ' ' VAL . 11.2 p -66.46 -37.38 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.189 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.57 -34.24 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.142 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 388' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 12.1 mt-10 -62.74 -34.83 78.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.57 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -70.27 -34.7 73.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.451 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' ' 386' ' ' VAL . 21.5 t -69.87 -46.35 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.353 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 394' ' ' GLU . 14.5 pt20 -58.46 -37.49 75.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.696 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 392' ' ' TYR . . . . . 0.408 ' O ' ' CG ' ' A' ' 395' ' ' GLN . 19.1 t80 -72.34 -35.1 68.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.205 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.674 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -70.35 -37.84 74.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.728 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 394' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 391' ' ' GLN . 0.0 OUTLIER -64.87 -38.88 92.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 395' ' ' GLN . . . . . 0.42 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 12.0 pt20 -69.77 -31.65 69.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.849 0.357 . . . . 0.0 110.467 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -68.73 -39.37 80.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.653 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.731 HG13 ' CD2' ' A' ' 412' ' ' LEU . 42.6 t -60.74 -47.29 93.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.593 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -56.69 -38.69 72.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.462 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -74.28 -58.09 3.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.38 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.838 ' CE1' HD22 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -56.86 125.15 21.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.367 0.603 . . . . 0.0 110.456 179.729 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.571 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.7 p -116.53 43.9 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.512 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.576 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.8 -164.3 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.841 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.452 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.83 143.79 48.57 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.789 0.328 . . . . 0.0 111.632 -179.525 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.494 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 7.9 mttt -61.53 -21.13 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.941 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 405' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 405' ' ' THR . 23.7 m -94.22 8.67 40.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.85 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.452 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t70 -115.07 161.78 17.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.976 0.417 . . . . 0.0 111.027 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.736 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.59 -30.0 65.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.3 179.438 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.62 ' HB1' ' HE2' ' A' ' 400' ' ' PHE . . . -62.81 -29.41 70.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.1 -179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.494 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 6.1 t80 -73.72 -46.13 47.89 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.296 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.736 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.3 p-90 -73.08 -29.01 62.64 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 118.853 -1.139 . . . . 0.0 108.78 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.613 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.6 tp -67.35 -39.81 85.77 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.886 177.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.838 HD22 ' CE1' ' A' ' 400' ' ' PHE . 2.6 tp -59.67 -46.91 87.63 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 1.6 tt0 -69.85 -31.68 69.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.421 177.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.613 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 2.4 mm-40 -63.48 -38.67 92.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.271 -179.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 1.9 mmt -69.72 -44.64 69.89 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.749 0.309 . . . . 0.0 111.004 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.875 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.0 -37.17 78.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.578 -179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.875 ' N ' HD12 ' A' ' 416' ' ' LEU . 1.0 OUTLIER -68.38 -43.75 76.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.733 0.302 . . . . 0.0 111.152 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -57.98 -47.22 83.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.382 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.451 ' OE2' HD13 ' A' ' 393' ' ' LEU . 13.6 pt-20 -65.9 -34.94 79.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.598 ' HB2' HG21 ' A' ' 445' ' ' ILE . 0.2 OUTLIER -67.05 -39.05 86.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.1 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.32 -31.8 69.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.918 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.01 -44.42 76.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.921 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.01 -35.86 77.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.878 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -79.35 -20.89 46.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 16.7 t -54.02 -30.91 49.53 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.89 0.376 . . . . 0.0 111.036 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.7 t -79.65 116.08 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.961 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.23 -34.01 61.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.447 HG22 ' HB2' ' A' ' 431' ' ' GLN . 0.2 OUTLIER 66.32 131.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.127 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.98 -89.2 1.79 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.372 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -107.86 64.63 0.26 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.335 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.497 ' HB3' HG23 ' A' ' 434' ' ' VAL . 49.4 mm-40 -139.56 87.5 2.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.851 0.358 . . . . 0.0 110.899 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -40.95 95.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.975 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 2.9 t -59.11 -43.28 91.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.011 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 431' ' ' GLN . 34.3 t -69.11 -35.53 68.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -44.47 78.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -69.31 -33.0 72.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.998 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.51 -44.73 67.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.433 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.897 ' O ' HG23 ' A' ' 442' ' ' VAL . 6.4 ptm180 -69.52 -40.66 76.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.214 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -44.9 82.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.891 0.377 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -69.82 -39.44 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.524 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.136 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 438' ' ' ARG . 41.0 t -62.94 -45.6 98.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.072 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 443' ' ' CYS . . . . . 0.599 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.6 m -60.38 -30.35 69.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.725 0.297 . . . . 0.0 110.213 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 444' ' ' LYS . . . . . 0.42 ' O ' HG13 ' A' ' 448' ' ' ILE . 37.9 tttp -63.94 -43.14 96.73 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.893 ' HA ' HD12 ' A' ' 448' ' ' ILE . 0.9 OUTLIER -73.62 -34.85 42.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.935 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.599 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.3 OUTLIER -60.7 -48.02 83.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.709 178.871 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -55.85 -42.7 76.21 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.72 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 445' ' ' ILE . 11.3 mt -64.52 -36.33 77.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.837 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.13 -44.66 83.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.894 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 -44.07 64.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 0.0 110.193 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 31.1 mtmm -57.86 -29.94 65.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.17 0.509 . . . . 0.0 109.666 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.759 HD11 HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -73.73 -36.71 65.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.441 179.304 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -29.98 67.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -93.68 -19.34 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm -82.55 -20.81 35.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.735 0.303 . . . . 0.0 110.919 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.42 ' HA3' ' CD2' ' A' ' 409' ' ' TYR . . . -82.12 -101.37 0.43 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.43 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.278 -0.868 . . . . 0.0 110.945 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.519 -0.236 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.73 HG22 HD11 ' A' ' 384' ' ' ILE . 31.2 mm -58.65 -29.75 40.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.486 ' HA ' HG12 ' A' ' 384' ' ' ILE . 11.5 mttt -56.77 -33.17 66.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.047 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.603 ' O ' HG23 ' A' ' 386' ' ' VAL . 4.2 pttm -68.27 -38.0 81.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.164 0.507 . . . . 0.0 110.517 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.571 HG21 ' HB1' ' A' ' 437' ' ' ALA . 43.6 mm -60.5 -33.37 54.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.521 178.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.73 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.84 -44.73 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.209 178.495 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -57.0 -49.38 75.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.48 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 382' ' ' LYS . 40.9 t -64.15 -36.13 75.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.41 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.596 ' O ' HD23 ' A' ' 387' ' ' LEU . 6.0 tt -67.46 -34.54 77.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.375 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 388' ' ' GLU . . . . . 0.442 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.0 tt0 -62.77 -35.0 78.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.622 179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -70.41 -34.57 72.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.728 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.679 HG22 ' OE2' ' A' ' 419' ' ' GLU . 25.8 t -65.35 -46.91 89.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 4.6 pt20 -63.15 -37.76 88.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.84 0.352 . . . . 0.0 110.708 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.22 -36.87 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.09 179.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.924 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.5 mt -65.91 -37.77 86.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.296 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 394' ' ' GLU . . . . . 0.409 ' HG3' ' CD1' ' A' ' 448' ' ' ILE . 2.6 mt-10 -58.7 -44.53 90.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.561 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -41.35 89.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.461 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -69.2 -39.92 78.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.013 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 393' ' ' LEU . 25.2 t -60.62 -30.66 47.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.803 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -66.83 -33.13 74.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.415 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' A' ' 400' ' ' PHE . 16.5 tt0 -89.43 -55.41 3.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.533 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.962 ' CD2' HD22 ' A' ' 412' ' ' LEU . 13.8 t80 -20.35 120.27 0.03 OUTLIER 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 401' ' ' VAL . 11.6 p -100.5 29.43 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.625 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.563 ' HA3' ' CE2' ' A' ' 400' ' ' PHE . . . -41.9 162.8 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.527 -0.761 . . . . 0.0 113.777 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.543 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 1.4 mppt? -133.56 143.67 48.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.151 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -17.46 53.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.703 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.4 m -108.4 -15.54 14.43 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.547 ' OD1' ' HB3' ' A' ' 408' ' ' ALA . 14.2 t70 -76.24 135.25 39.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.925 0.393 . . . . 0.0 110.743 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.741 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 mptp? -61.13 -30.82 70.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.214 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.547 ' HB3' ' OD1' ' A' ' 406' ' ' ASP . . . -65.41 -29.13 69.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.409 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 0.2 OUTLIER -68.95 -45.59 70.34 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.539 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.741 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 15.7 p-90 -72.86 -30.13 63.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.069 -1.053 . . . . 0.0 108.886 178.369 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 25.9 tp -69.76 -38.56 76.81 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.327 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.973 HD23 HD11 ' A' ' 452' ' ' LEU . 0.4 OUTLIER -62.09 -47.26 85.42 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.147 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.823 ' HA ' HD12 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.58 -32.28 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.302 177.826 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.77 -36.42 83.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.532 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.617 ' CE ' HD21 ' A' ' 393' ' ' LEU . 10.9 ttt -69.57 -41.05 76.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.004 0.431 . . . . 0.0 110.171 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.823 HD12 ' HA ' ' A' ' 413' ' ' GLU . 3.9 mt -62.43 -46.92 86.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.639 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.531 HG22 HD13 ' A' ' 421' ' ' LEU . 7.6 m -65.8 -30.44 71.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.767 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -47.31 86.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.159 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.679 ' OE2' HG22 ' A' ' 390' ' ' VAL . 8.5 pt-20 -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.584 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.78 HD21 HG22 ' A' ' 442' ' ' VAL . 3.4 tm? -68.49 -38.85 81.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.472 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.531 HD13 HG22 ' A' ' 417' ' ' THR . 1.3 mp -66.56 -31.98 73.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.668 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -45.07 86.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.748 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.533 HD11 HG11 ' A' ' 386' ' ' VAL . 5.5 mt -57.69 -32.57 67.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -79.88 -31.84 40.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 10.0 t -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 426' ' ' VAL . . . . . 0.44 HG11 ' HE3' ' A' ' 382' ' ' LYS . 21.5 t -80.56 119.64 30.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.078 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -70.39 131.66 44.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.933 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.402 ' CG2' HG11 ' A' ' 434' ' ' VAL . 19.0 p -108.48 -36.91 6.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.888 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 90.39 -91.96 1.73 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.488 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -152.54 47.78 0.55 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.5 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.443 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.1 OUTLIER -93.01 115.64 28.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 0.0 110.797 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -42.97 80.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 25.6 t -64.2 -44.86 90.66 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.923 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.443 HG23 ' HB3' ' A' ' 431' ' ' GLN . 37.8 t -69.55 -40.76 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -44.35 91.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.926 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -38.35 78.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 0.571 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -66.64 -45.13 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.273 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.707 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.2 ptm180 -68.11 -39.37 82.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.956 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -66.25 -34.44 78.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -71.39 -39.34 71.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.88 97.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.158 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.78 HG22 HD21 ' A' ' 420' ' ' LEU . 31.5 t -62.85 -39.64 85.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.996 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -36.63 79.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.492 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -34.69 78.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.572 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 442' ' ' VAL . 3.1 mm -66.78 -31.19 52.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.14 0.495 . . . . 0.0 110.751 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -45.99 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.663 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.47 -38.46 87.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.039 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.771 ' CG2' HG21 ' A' ' 397' ' ' VAL . 16.3 mt -74.83 -36.57 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.51 -43.56 84.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.938 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.77 62.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.629 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -57.84 -32.67 67.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 109.808 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.973 HD11 HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -77.64 -36.6 51.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.402 179.145 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.17 -30.0 61.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.553 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -91.95 -12.4 33.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.176 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -82.16 -26.4 33.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.125 0.488 . . . . 0.0 110.828 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -82.97 -96.32 0.55 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.375 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.008 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 81.3 p . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 120.694 0.283 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.629 HG22 HD11 ' A' ' 384' ' ' ILE . 28.9 mm -58.6 -29.65 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -33.2 66.35 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.849 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -67.25 -38.02 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.091 0.472 . . . . 0.0 110.836 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 380' ' ' ILE . 34.3 mt -60.52 -34.54 58.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.376 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.629 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.94 -44.67 44.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.318 178.444 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.02 -49.35 76.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.411 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.52 -37.78 80.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.483 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.627 ' O ' HG12 ' A' ' 390' ' ' VAL . 4.3 tt -67.57 -32.96 74.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.82 -35.21 79.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.48 66.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.147 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.4 p -63.5 -39.09 84.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.479 -179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.16 -34.52 77.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.901 0.381 . . . . 0.0 110.627 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.99 -43.46 95.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.579 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.65 HD13 ' OE1' ' A' ' 419' ' ' GLU . 0.2 OUTLIER -60.55 -37.91 82.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.596 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -58.79 -44.05 90.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.485 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.62 -31.65 72.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.509 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -68.42 -44.17 75.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.837 HG22 HD11 ' A' ' 412' ' ' LEU . 19.7 t -60.68 -38.05 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.821 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -59.49 -32.58 70.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.522 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 401' ' ' VAL . 9.6 tt0 -78.63 -57.35 3.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.555 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.662 ' CG ' HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -60.34 127.7 33.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.288 0.566 . . . . 0.0 110.53 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.575 ' O ' HG12 ' A' ' 401' ' ' VAL . 22.1 t -123.11 39.86 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.401 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.545 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -53.76 -166.13 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.678 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.518 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.96 149.19 51.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 0.0 111.853 -179.603 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.493 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 2.0 mmmt -58.78 -25.09 62.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.081 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 70.9 p -85.94 3.7 40.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.448 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.518 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 26.4 t70 -111.96 156.68 21.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.111 0.482 . . . . 0.0 111.432 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.759 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.4 mttp -69.31 -29.97 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.039 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.516 ' HB1' ' HE2' ' A' ' 400' ' ' PHE . . . -62.87 -29.42 70.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.328 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.493 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 33.1 t80 -69.2 -45.53 69.65 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.969 -179.055 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.759 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.3 OUTLIER -72.63 -32.66 66.07 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 118.628 -1.229 . . . . 0.0 108.539 178.162 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.588 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 17.8 tp -63.57 -38.35 90.79 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.837 HD11 HG22 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -59.71 -47.15 86.8 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.465 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.493 ' HG2' HD13 ' A' ' 452' ' ' LEU . 4.8 mm-40 -70.38 -31.78 69.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.893 177.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.588 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.32 -40.17 96.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.222 -178.581 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.62 -44.2 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.222 0.534 . . . . 0.0 109.909 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.836 HD11 HG23 ' A' ' 445' ' ' ILE . 7.0 tp -66.36 -41.0 90.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.78 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.43 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 94.9 m -62.69 -30.36 71.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -71.01 -44.65 65.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.596 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.799 ' O ' HD12 ' A' ' 423' ' ' LEU . 15.8 pt-20 -64.23 -44.64 91.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.625 0.25 . . . . 0.0 111.41 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.961 ' HB2' HD13 ' A' ' 445' ' ' ILE . 1.4 pp -66.27 -35.34 80.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.893 0.378 . . . . 0.0 110.511 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.59 HD12 ' CD1' ' A' ' 420' ' ' LEU . 3.9 mp -70.31 -31.87 69.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.446 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.53 -46.28 90.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 419' ' ' GLU . 1.8 mp -66.12 -31.01 71.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.719 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -58.37 -26.5 63.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.01 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.05 38.35 1.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.863 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 14.2 p -91.19 130.02 41.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.64 -70.13 0.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.984 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.509 ' OG1' HG11 ' A' ' 434' ' ' VAL . 27.5 m 67.25 -69.5 0.13 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.028 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 98.37 -60.58 0.92 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 177.76 38.39 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.421 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.528 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.9 OUTLIER -93.43 120.08 33.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.818 0.342 . . . . 0.0 110.926 -179.963 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -31.07 69.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 21.5 t -65.42 -42.03 92.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.932 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.528 HG23 ' HB3' ' A' ' 431' ' ' GLN . 39.9 t -68.29 -37.45 77.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.92 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.755 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.16 -34.37 74.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.924 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.04 -45.16 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.504 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.0 OUTLIER -66.45 -44.24 83.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.972 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -60.46 -39.45 87.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -69.76 -31.71 69.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.727 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.421 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -69.4 -45.66 68.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.11 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 1.005 ' HA ' HD12 ' A' ' 445' ' ' ILE . 25.6 t -64.25 -34.3 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.866 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -45.09 95.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.215 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -37.2 86.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.083 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 1.005 HD12 ' HA ' ' A' ' 442' ' ' VAL . 24.2 mt -64.36 -32.73 58.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.704 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.58 -47.59 83.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.011 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.84 -42.45 93.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.17 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.413 ' CG2' HD22 ' A' ' 416' ' ' LEU . 34.2 mt -63.6 -36.56 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.803 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.417 HD12 ' OE2' ' A' ' 413' ' ' GLU . 2.3 tp -57.58 -47.59 81.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.817 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -34.53 68.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -57.87 -33.2 68.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.987 0.422 . . . . 0.0 110.313 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.83 HD21 HD12 ' A' ' 412' ' ' LEU . 1.8 mt -77.66 -36.79 51.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.434 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.92 -29.87 63.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.791 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -22.2 17.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.059 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -82.43 -19.88 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.958 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -86.32 -103.51 0.76 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.418 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.963 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.159 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.551 HG22 HD11 ' A' ' 384' ' ' ILE . 6.0 mt -58.85 -29.91 41.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.564 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.468 ' HA ' HG12 ' A' ' 384' ' ' ILE . 1.3 mttt -56.96 -33.15 66.76 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.868 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.593 ' O ' HG23 ' A' ' 386' ' ' VAL . 2.8 mttm -66.69 -38.04 85.98 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 33.7 mm -60.52 -35.59 64.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.293 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.586 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.91 -44.55 44.9 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.387 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.516 178.383 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -49.25 75.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.782 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.774 HG11 ' HB3' ' A' ' 423' ' ' LEU . 46.5 t -63.77 -33.65 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.672 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.25 -37.84 84.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.558 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 388' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 10.3 mt-10 -62.6 -34.64 77.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.744 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -67.58 -34.66 77.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.477 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.714 HG22 HD11 ' A' ' 445' ' ' ILE . 32.4 t -66.21 -46.69 86.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.2 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 11.7 pt20 -62.89 -40.47 97.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.863 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 392' ' ' TYR . . . . . 0.415 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 0.2 OUTLIER -68.92 -44.18 73.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.855 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.729 ' O ' HG23 ' A' ' 397' ' ' VAL . 1.1 mm? -58.57 -40.26 82.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.764 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -59.8 -46.61 88.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.018 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.5 -36.14 75.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.14 -41.73 76.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.388 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 393' ' ' LEU . 19.7 t -60.57 -45.75 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.328 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -24.12 31.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.006 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.835 ' O ' HG23 ' A' ' 401' ' ' VAL . 22.6 tt0 -95.77 -55.72 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 1.003 ' CE1' HD22 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -51.85 -27.08 11.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 -179.397 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.835 HG23 ' O ' ' A' ' 399' ' ' GLU . 21.1 t 66.4 -44.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.627 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.559 ' CA ' ' CZ ' ' A' ' 400' ' ' PHE . . . 68.22 158.22 1.18 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.013 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.534 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.3 143.6 49.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.601 179.372 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -67.68 -15.05 63.45 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.6 t -115.54 8.96 15.28 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 35.9 t0 -100.67 136.6 40.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.833 0.349 . . . . 0.0 110.8 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.763 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.31 -31.8 71.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.887 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.97 -29.03 70.5 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.712 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.534 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -65.9 -45.31 82.42 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.763 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.9 p-90 -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.177 178.358 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.581 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 18.0 tp -69.65 -38.89 77.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.642 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 1.003 HD22 ' CE1' ' A' ' 400' ' ' PHE . 0.3 OUTLIER -62.55 -46.99 85.86 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.141 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.852 ' HG2' HD13 ' A' ' 452' ' ' LEU . 21.5 mt-10 -70.32 -32.42 70.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.429 177.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.581 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 4.5 mt-10 -66.38 -44.6 82.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.9 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 412' ' ' LEU . 8.3 ptm -65.71 -42.43 91.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.679 0.276 . . . . 0.0 111.312 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.658 HD21 ' HA ' ' A' ' 413' ' ' GLU . 3.1 pp -67.24 -36.69 82.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.907 0.384 . . . . 0.0 110.663 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.572 ' N ' HD12 ' A' ' 416' ' ' LEU . 0.7 OUTLIER -62.79 -33.89 76.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.737 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 418' ' ' LYS . . . . . 0.637 ' HA ' HD12 ' A' ' 421' ' ' LEU . 7.8 mttt -73.06 -34.15 66.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.052 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 416' ' ' LEU . 7.7 pt-20 -72.83 -38.31 67.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.849 HD12 ' N ' ' A' ' 421' ' ' LEU . 4.3 pp -70.5 -43.71 69.13 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.035 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.986 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.56 -31.45 68.48 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.163 -179.288 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 422' ' ' GLU . . . . . 0.986 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.1 OUTLIER -64.35 -46.72 82.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.82 0.343 . . . . 0.0 111.47 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.774 ' HB3' HG11 ' A' ' 386' ' ' VAL . 1.9 pp -68.02 -30.94 70.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.167 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 -3.83 41.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.525 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.2 m -86.16 -5.03 59.28 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.553 0.216 . . . . 0.0 111.56 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 426' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 423' ' ' LEU . 26.8 m -66.68 137.82 24.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.864 0.364 . . . . 0.0 111.066 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -73.06 156.49 38.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.887 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 69.1 p -137.24 110.68 7.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.907 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -82.43 -37.0 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.439 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 172.81 49.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.486 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.405 ' HB3' HG23 ' A' ' 434' ' ' VAL . 15.9 mt-30 -126.73 111.33 14.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.772 0.32 . . . . 0.0 110.93 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -67.1 -32.45 73.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.929 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -40.94 96.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 431' ' ' GLN . 25.8 t -71.57 -39.82 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.093 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -44.67 90.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.745 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.53 -43.17 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.161 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.18 91.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.754 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.429 ' O ' HG23 ' A' ' 442' ' ' VAL . 10.1 ptt85 -70.31 -40.42 74.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.68 0.276 . . . . 0.0 111.042 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.84 -32.91 74.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.07 -41.98 63.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.401 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -62.03 -45.57 92.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.21 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.771 HG13 ' HB2' ' A' ' 420' ' ' LEU . 46.2 t -69.55 -38.83 77.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.712 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.36 -39.21 93.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.873 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -63.19 -40.72 98.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.515 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.714 HD11 HG22 ' A' ' 390' ' ' VAL . 0.5 OUTLIER -63.81 -31.18 52.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.798 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -64.2 -41.04 97.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.879 179.327 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.62 -37.27 83.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.237 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 31.7 mt -67.3 -36.4 76.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.58 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 446' ' ' GLN . 1.8 mt -57.29 -46.99 82.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.5 -46.13 89.83 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -58.43 -30.02 66.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.241 0.543 . . . . 0.0 109.614 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.876 HD11 HD23 ' A' ' 412' ' ' LEU . 1.0 OUTLIER -77.29 -36.77 53.89 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.335 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -61.73 -31.8 71.99 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.38 -19.35 20.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.971 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.9 mtmt -82.45 -23.37 34.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.353 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.422 ' HA2' ' O ' ' A' ' 402' ' ' GLY . . . -72.32 -93.13 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.6 mp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.217 179.796 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 63.7 m . . . . . 0 CA--C 1.52 -0.175 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.639 HG22 HD11 ' A' ' 384' ' ' ILE . 34.1 mm -58.68 -30.11 41.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.418 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -59.0 -33.32 70.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.884 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.453 ' O ' HG23 ' A' ' 386' ' ' VAL . 7.5 mtpp -68.19 -38.12 81.66 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.17 0.509 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 37.9 mm -60.45 -34.55 58.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.411 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.639 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.95 -44.72 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.414 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -47.19 80.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.009 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.495 HG12 HD21 ' A' ' 423' ' ' LEU . 47.5 t -70.39 -42.85 78.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.124 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.08 -38.88 92.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.771 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -62.75 -34.71 77.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -40.9 96.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.389 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.57 HG13 ' CD1' ' A' ' 445' ' ' ILE . 56.2 t -61.42 -37.94 78.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.591 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -41.13 93.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.71 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -72.53 -44.54 62.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.642 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.667 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.5 mm? -59.01 -42.48 90.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.755 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.28 -44.33 95.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -35.86 77.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.015 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -45.02 71.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.792 HG21 ' CG2' ' A' ' 448' ' ' ILE . 17.1 t -60.58 -39.6 81.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.975 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -58.52 -38.91 78.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.012 0.434 . . . . 0.0 110.333 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -80.67 -54.45 5.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.349 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.616 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 42.8 t80 -21.4 116.86 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.401 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 25.5 m -111.21 27.03 2.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.192 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.616 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -54.72 -172.82 0.08 OUTLIER Glycine 0 N--CA 1.442 -0.962 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.326 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.515 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.89 143.86 48.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.781 -0.71 . . . . 0.0 111.236 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.406 ' HB2' ' CA ' ' A' ' 457' ' ' LEU . 0.0 OUTLIER -52.25 -27.38 14.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.525 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.32 11.32 29.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.599 -179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -93.17 142.67 27.04 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.784 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.19 -30.29 70.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.983 0.42 . . . . 0.0 110.665 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -68.0 -29.16 68.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.836 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.515 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -66.52 -45.29 79.99 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.784 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 9.3 p-90 -72.67 -30.58 64.39 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 119.045 -1.062 . . . . 0.0 109.13 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.591 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.8 tp -69.79 -38.49 76.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.303 177.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.594 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -63.03 -47.07 84.63 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.092 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.504 ' HA ' HD21 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.33 -32.04 69.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.372 177.86 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.87 -41.46 97.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.49 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 18.5 ptp -69.58 -44.54 70.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.637 0.256 . . . . 0.0 111.448 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.737 HD12 ' N ' ' A' ' 417' ' ' THR . 4.3 pp -66.48 -37.1 84.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.884 0.373 . . . . 0.0 110.231 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.737 ' N ' HD12 ' A' ' 416' ' ' LEU . 99.2 m -62.85 -30.39 71.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.208 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 418' ' ' LYS . . . . . 0.58 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -72.24 -32.65 66.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.913 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.589 ' O ' HD12 ' A' ' 423' ' ' LEU . 6.8 mm-40 -72.72 -46.38 53.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.307 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 421' ' ' LEU . 2.5 pp -62.96 -46.21 88.79 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.21 -178.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.985 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -68.2 -31.44 70.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 110.817 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 422' ' ' GLU . . . . . 0.985 ' N ' HD13 ' A' ' 421' ' ' LEU . 1.3 tm-20 -58.33 -46.44 86.19 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.842 0.353 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.672 HD22 ' HB3' ' A' ' 441' ' ' ALA . 0.7 OUTLIER -69.08 -33.56 73.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.75 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -68.06 -28.3 67.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.962 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.5 p -96.57 38.53 1.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 426' ' ' VAL . . . . . 0.625 HG11 ' HG3' ' A' ' 438' ' ' ARG . 10.2 p -86.14 137.78 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.85 110.03 16.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.04 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.3 t -156.02 121.7 4.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.16 -49.25 2.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.476 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -136.32 62.96 0.59 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.498 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.596 ' HB3' HG23 ' A' ' 434' ' ' VAL . 41.1 mt-30 -139.27 84.94 2.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.823 0.344 . . . . 0.0 110.922 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.56 -31.89 69.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -42.32 99.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.596 HG23 ' HB3' ' A' ' 431' ' ' GLN . 30.8 t -66.33 -45.6 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.068 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.78 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -68.14 -47.21 68.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.884 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.1 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.008 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.833 ' O ' HG23 ' A' ' 442' ' ' VAL . 17.7 mmt180 -67.61 -36.64 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -66.94 -44.77 79.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.722 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.91 -34.7 76.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.672 ' HB3' HD22 ' A' ' 423' ' ' LEU . . . -70.32 -45.02 67.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.041 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.833 HG23 ' O ' ' A' ' 438' ' ' ARG . 24.9 t -62.92 -45.91 97.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.99 -34.11 74.29 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.526 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.06 -36.4 83.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.944 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.78 ' HA ' HD12 ' A' ' 448' ' ' ILE . 1.7 mm -68.42 -31.31 50.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.292 179.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.63 -47.69 83.52 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.762 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.68 -35.36 80.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.425 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.792 ' CG2' HG21 ' A' ' 397' ' ' VAL . 10.3 mt -74.58 -36.44 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.772 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.4 -55.4 35.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.687 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.07 -37.92 81.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.24 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 7.0 mtmm -57.86 -31.6 66.84 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.654 HD23 HG13 ' A' ' 397' ' ' VAL . 1.5 tm? -68.38 -38.95 81.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.393 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -60.81 -30.0 69.8 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.23 -15.74 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.131 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -22.65 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 110.837 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.68 -100.61 0.71 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.406 ' CA ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.993 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.519 -0.231 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.737 ' HA ' HD12 ' A' ' 383' ' ' ILE . 32.8 mm -58.71 -29.84 40.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.462 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -37.28 70.82 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.16 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -64.59 -38.19 90.16 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.028 0.442 . . . . 0.0 111.185 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 380' ' ' ILE . 16.6 mt -61.19 -35.24 64.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.328 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.629 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -75.05 -44.78 43.83 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.332 178.463 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -56.69 -49.41 75.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.918 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.752 HG21 HD11 ' A' ' 423' ' ' LEU . 8.4 p -65.69 -42.93 93.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.859 179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.587 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.57 -32.65 73.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.784 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -35.18 79.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 389' ' ' LYS . . . . . 0.4 ' CD ' ' HB3' ' A' ' 419' ' ' GLU . 0.3 OUTLIER -70.38 -44.43 68.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.62 179.446 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 387' ' ' LEU . 1.6 p -66.45 -35.91 76.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.634 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -60.16 -40.66 90.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.533 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -35.07 68.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.83 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -68.87 -43.57 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.121 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 394' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 395' ' ' GLN . 0.1 OUTLIER -68.07 -33.28 74.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.777 0.323 . . . . 0.0 110.788 179.933 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 395' ' ' GLN . . . . . 0.425 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 1.8 tt0 -66.44 -35.59 80.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -69.1 -37.56 78.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.812 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.861 HG21 ' CG2' ' A' ' 448' ' ' ILE . 16.2 t -60.61 -40.49 84.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -55.86 -32.98 64.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.053 0.454 . . . . 0.0 110.301 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.43 ' O ' ' C ' ' A' ' 400' ' ' PHE . 30.6 tt0 -88.91 -54.34 4.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.296 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.672 ' CD1' HD23 ' A' ' 412' ' ' LEU . 35.1 t80 -20.84 124.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.131 -0.94 . . . . 0.0 113.299 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.0 p -120.9 24.77 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.392 178.311 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.636 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -59.61 -171.11 0.45 Allowed Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.949 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.83 143.45 48.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.288 -0.456 . . . . 0.0 111.354 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.463 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -53.1 -26.96 18.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.225 179.41 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.88 14.6 30.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.19 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -106.64 147.81 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.886 0.374 . . . . 0.0 110.957 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.794 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 2.3 ttpt -61.17 -30.33 70.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.691 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -66.09 -29.24 69.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.144 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 52.5 t80 -70.88 -45.94 63.49 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.794 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -72.97 -30.56 63.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 118.612 -1.235 . . . . 0.0 108.568 177.716 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 39.1 tp -66.41 -40.03 89.34 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.016 177.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.672 HD23 ' CD1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.79 -47.04 87.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.613 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.527 ' HA ' HD21 ' A' ' 416' ' ' LEU . 29.8 mt-10 -70.32 -31.99 69.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.779 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.602 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.52 -41.41 98.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.712 -178.902 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.652 ' HB2' HD11 ' A' ' 393' ' ' LEU . 6.5 mmm -69.53 -44.67 70.49 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.906 0.384 . . . . 0.0 110.936 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.699 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -68.59 -36.83 79.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.158 179.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.71 ' HA ' HD23 ' A' ' 420' ' ' LEU . 95.4 m -72.03 -30.32 65.07 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.595 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 418' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -62.58 -47.45 83.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.572 -179.651 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 416' ' ' LEU . 1.2 pp20? -65.3 -46.44 80.35 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.71 HD23 ' HA ' ' A' ' 417' ' ' THR . 0.3 OUTLIER -60.55 -34.51 74.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.102 0.477 . . . . 0.0 109.877 179.303 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.35 -31.77 69.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.179 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.23 -46.41 85.95 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.376 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.914 ' O ' HG13 ' A' ' 426' ' ' VAL . 1.3 mt -70.29 -45.74 65.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.614 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 40.88 37.36 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.745 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.0 t 59.75 55.09 4.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 426' ' ' VAL . . . . . 0.914 HG13 ' O ' ' A' ' 423' ' ' LEU . 3.6 m -66.38 117.65 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.056 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.32 149.91 27.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.052 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 428' ' ' THR . . . . . 0.519 HG23 ' NH1' ' A' ' 438' ' ' ARG . 72.4 p -110.86 -27.14 8.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.994 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 106.81 -27.19 17.14 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.354 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 168.42 41.27 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.27 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.44 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -116.46 96.86 5.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 0.0 110.958 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.86 -31.79 72.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.815 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.28 -43.85 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.835 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.555 HG12 ' CD ' ' A' ' 438' ' ' ARG . 38.8 t -68.08 -37.99 79.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -40.76 87.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -66.14 -38.3 87.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.787 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.68 -38.73 73.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.027 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.875 ' O ' HG23 ' A' ' 442' ' ' VAL . 6.0 mtp180 -62.13 -44.43 96.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.81 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -66.48 -37.05 84.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.81 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.47 -39.6 88.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.917 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.47 69.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.078 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 438' ' ' ARG . 31.8 t -62.88 -44.98 99.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.84 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.5 m -60.85 -34.91 75.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.236 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -63.16 -34.62 78.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.507 HG21 ' CD2' ' A' ' 420' ' ' LEU . 3.4 mm -66.35 -36.63 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-O 121.249 0.547 . . . . 0.0 110.531 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.92 -47.72 84.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.187 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.79 87.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.082 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.861 ' CG2' HG21 ' A' ' 397' ' ' VAL . 15.7 mt -73.52 -36.54 48.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.39 -46.67 83.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.905 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -38.33 70.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.524 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.85 -30.07 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.118 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.636 HD12 ' O ' ' A' ' 448' ' ' ILE . 2.1 mt -77.58 -36.62 51.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.594 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -29.96 60.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.857 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -96.6 -12.35 24.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.332 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.53 -24.02 34.29 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.746 0.308 . . . . 0.0 110.846 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.457 ' HA2' ' HA ' ' A' ' 403' ' ' LYS . . . -92.42 -76.19 1.32 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.632 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 93.6 p . . . . . 0 CA--C 1.519 -0.217 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.683 HG22 HD11 ' A' ' 384' ' ' ILE . 27.7 mm -58.76 -29.82 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.456 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.36 -33.25 67.59 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.983 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 386' ' ' VAL . 7.0 mttm -68.23 -38.1 81.5 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.174 0.512 . . . . 0.0 110.782 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.558 HD12 HD13 ' A' ' 380' ' ' ILE . 50.2 mt -60.5 -34.14 57.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.433 178.787 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.683 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.94 -44.8 44.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.469 178.649 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -58.57 -49.4 77.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.084 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.761 HG11 ' HB3' ' A' ' 423' ' ' LEU . 46.8 t -68.31 -46.17 81.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.156 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.846 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.77 -34.88 78.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.21 0.529 . . . . 0.0 109.834 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -38.96 81.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.506 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 386' ' ' VAL . 24.3 t -67.3 -36.0 75.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.741 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -61.43 -41.11 96.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.664 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.82 -45.6 67.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.544 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.709 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -60.84 -38.0 83.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.59 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -60.68 -42.03 96.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.698 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -58.06 -44.82 87.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.827 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.25 -45.25 70.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.775 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 393' ' ' LEU . 58.2 t -60.64 -32.55 51.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.706 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.12 -34.72 76.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.044 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' O ' ' A' ' 400' ' ' PHE . 6.6 tt0 -91.43 -68.62 0.78 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.17 179.404 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.786 ' CE1' HD13 ' A' ' 412' ' ' LEU . 4.7 t80 54.55 157.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.591 0.71 . . . . 0.0 111.888 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 5.0 m -141.12 20.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.853 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.567 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -104.08 -170.46 25.12 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.889 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -134.14 143.93 48.24 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.58 -0.31 . . . . 0.0 111.68 -179.545 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 3.2 tttt -51.13 -28.77 11.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.138 179.214 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.74 14.34 32.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.391 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.19 164.97 11.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.816 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.41 -30.8 66.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.14 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.02 -29.14 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.027 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 18.5 t80 -69.38 -45.43 69.34 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.816 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.75 64.34 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.903 178.18 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -68.1 -39.33 82.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.454 177.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.786 HD13 ' CE1' ' A' ' 400' ' ' PHE . 10.0 tp -61.28 -46.85 88.64 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.33 -31.9 69.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.657 177.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 0.4 OUTLIER -63.38 -44.6 94.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.959 -179.166 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 6.3 ptp -66.29 -36.9 84.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.071 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.471 ' O ' HD12 ' A' ' 416' ' ' LEU . 8.5 tp -68.69 -41.91 78.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.493 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -32.83 73.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.843 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.55 -47.19 76.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.522 ' CD ' HD13 ' A' ' 393' ' ' LEU . 15.3 pt-20 -66.29 -40.3 89.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.902 0.382 . . . . 0.0 110.704 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.853 HD22 HD11 ' A' ' 423' ' ' LEU . 1.0 OUTLIER -66.46 -33.58 76.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.094 0.473 . . . . 0.0 110.381 179.561 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.64 -31.79 68.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.102 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -46.52 73.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.32 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 1.03 HD22 ' HB1' ' A' ' 441' ' ' ALA . 3.3 pp -65.24 -31.18 72.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.339 . . . . 0.0 110.939 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 424' ' ' ASP . . . . . 0.625 ' N ' HD12 ' A' ' 423' ' ' LEU . 12.4 t70 -70.09 -26.82 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 1.8 t -57.96 -25.92 61.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.159 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 23.7 t -66.63 134.86 29.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.89 0.376 . . . . 0.0 111.098 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -101.82 -177.79 3.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -151.13 138.38 19.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.86 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.87 28.27 16.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.547 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 97.16 43.68 2.97 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.467 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.695 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.3 mm-40 -116.43 129.05 56.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.862 0.363 . . . . 0.0 110.831 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -67.19 -37.45 83.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.34 -43.93 95.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.817 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.695 HG23 ' HB3' ' A' ' 431' ' ' GLN . 29.4 t -60.64 -46.1 96.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.08 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -34.3 74.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.782 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -64.71 -34.31 78.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.829 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.56 -43.64 69.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.155 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.776 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.3 mmp_? -61.89 -44.53 96.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.924 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.49 -43.09 99.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.012 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.45 -45.0 95.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.074 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 1.03 ' HB1' HD22 ' A' ' 423' ' ' LEU . . . -70.88 -45.58 64.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.319 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 438' ' ' ARG . 38.5 t -69.37 -30.7 46.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.025 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 54.1 t -70.66 -43.09 69.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.78 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.83 -44.58 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.062 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.85 HG12 HD23 ' A' ' 420' ' ' LEU . 2.8 pp -63.27 -31.12 51.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.765 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.609 ' N ' HD12 ' A' ' 445' ' ' ILE . 5.8 tp-100 -64.48 -46.57 82.48 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.631 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -58.97 -36.79 75.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.682 HG22 HG11 ' A' ' 397' ' ' VAL . 24.4 mt -66.78 -36.53 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.9 tt -57.64 -58.71 7.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.813 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.94 -38.05 81.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.415 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.4 mmpp? -57.94 -29.88 65.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.636 ' HG ' HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -71.33 -38.86 71.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.525 179.311 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.68 -29.98 65.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.121 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -20.7 23.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -20.6 36.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.768 0.318 . . . . 0.0 110.981 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.46 -90.33 0.18 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.329 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.216 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.662 HG22 HD11 ' A' ' 384' ' ' ILE . 1.7 mp -58.6 -29.58 39.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.443 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.8 OUTLIER -56.94 -33.85 67.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.252 -179.517 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -68.43 -38.11 80.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.127 0.489 . . . . 0.0 110.827 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.691 HG13 HG13 ' A' ' 434' ' ' VAL . 40.7 mm -60.52 -33.98 56.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.524 178.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.662 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.94 -44.78 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.584 178.582 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 385' ' ' HIS . . . . . 0.415 ' CG ' ' N ' ' A' ' 386' ' ' VAL . 0.0 OUTLIER -59.26 -49.47 77.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.511 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.904 HG21 ' HG ' ' A' ' 423' ' ' LEU . 14.7 p -64.0 -43.5 97.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.59 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.448 ' N ' HG13 ' A' ' 386' ' ' VAL . 2.2 tt -60.7 -34.43 74.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.384 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 388' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 3.2 mt-10 -62.8 -35.01 78.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.519 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 -34.48 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.55 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.452 HG13 HG22 ' A' ' 445' ' ' ILE . 22.5 t -61.63 -46.85 95.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.488 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.6 pt20 -64.98 -35.51 81.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.836 0.35 . . . . 0.0 110.797 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -40.8 74.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.632 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.545 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -64.0 -41.7 97.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.618 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.21 -38.54 83.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.22 -35.34 80.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.826 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -69.27 -39.9 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 393' ' ' LEU . 23.5 t -60.71 -44.85 98.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.028 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -55.76 -40.32 72.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 400' ' ' PHE . 15.3 tt0 -78.19 -53.93 6.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.304 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.604 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 35.1 t80 -22.65 123.28 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.09 -0.959 . . . . 0.0 113.145 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 401' ' ' VAL . 11.6 p -118.33 24.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.444 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.604 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -61.09 -169.37 0.58 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.941 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.556 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 0.3 OUTLIER -133.7 143.64 48.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.498 . . . . 0.0 111.17 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.406 ' N ' ' HA3' ' A' ' 456' ' ' GLY . 0.2 OUTLIER -50.16 -27.99 6.7 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.593 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.87 11.99 19.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 29.8 t70 -93.5 154.61 17.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 110.963 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -32.72 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.557 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -63.0 -45.9 90.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.897 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.556 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 11.8 t80 -61.34 -44.53 97.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.919 0.39 . . . . 0.0 110.672 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.481 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -59.13 -48.65 80.84 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.2 tp -65.01 -38.47 91.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.76 HD12 HD13 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.04 -47.43 86.43 Favored 'General case' 0 C--N 1.339 0.113 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -70.68 -32.29 69.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.572 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.6 mt-10 -63.7 -39.65 94.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.838 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 1.6 ttt -69.45 -42.01 75.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.959 0.409 . . . . 0.0 110.167 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.69 HD12 HD12 ' A' ' 449' ' ' LEU . 0.9 OUTLIER -61.04 -40.41 93.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.549 179.548 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.578 ' HA ' HD21 ' A' ' 420' ' ' LEU . 2.7 m -64.13 -32.97 74.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.446 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 418' ' ' LYS . . . . . 0.725 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -73.12 -23.58 60.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.891 ' HG2' HG21 ' A' ' 445' ' ' ILE . 0.4 OUTLIER -72.81 -46.64 52.08 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.056 -179.748 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.812 ' HB2' HG13 ' A' ' 442' ' ' VAL . 0.8 OUTLIER -64.79 -50.19 67.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.242 -178.965 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.981 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -64.29 -31.38 72.57 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.176 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 422' ' ' GLU . . . . . 0.981 ' N ' HD13 ' A' ' 421' ' ' LEU . 5.3 tp10 -64.25 -38.77 92.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.904 ' HG ' HG21 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -73.83 -31.19 63.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.007 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -74.16 -28.15 61.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.966 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 83.1 p -98.69 39.73 1.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 426' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 423' ' ' LEU . 23.8 t -101.07 136.74 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.35 138.8 58.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.9 p -153.94 163.7 39.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.925 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -173.75 98.67 0.13 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.17 49.74 55.7 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.466 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.462 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.8 mt-30 -147.76 87.25 1.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.838 0.351 . . . . 0.0 110.952 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -64.58 -33.88 76.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.928 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 9.5 m -60.54 -44.74 95.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.923 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.691 HG13 HG13 ' A' ' 383' ' ' ILE . 32.6 t -66.53 -36.13 76.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.44 -39.15 85.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.861 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -69.1 -32.93 72.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.951 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.82 -45.23 62.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.237 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -62.23 -31.53 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.56 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -67.97 -37.52 81.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.885 ' HB3' HD22 ' A' ' 423' ' ' LEU . . . -61.87 -45.66 92.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.865 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.812 HG13 ' HB2' ' A' ' 420' ' ' LEU . 57.8 t -66.99 -36.31 76.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 16.0 m -70.9 -46.77 61.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.658 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -44.57 89.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.892 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.891 HG21 ' HG2' ' A' ' 419' ' ' GLU . 2.8 pp -63.21 -31.36 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.191 0.52 . . . . 0.0 110.294 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.545 ' N ' HD12 ' A' ' 445' ' ' ILE . 4.8 tp-100 -59.09 -47.73 84.19 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.586 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.13 -37.41 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.335 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.48 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.9 mt -69.08 -36.36 73.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.594 179.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.69 HD12 HD12 ' A' ' 416' ' ' LEU . 6.2 tt -57.49 -47.28 82.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.66 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -37.84 88.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.246 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -30.14 65.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.803 178.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.76 HD13 HD12 ' A' ' 412' ' ' LEU . 4.8 tp -73.09 -36.69 66.84 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.291 179.271 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -57.07 -29.92 63.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.477 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm -92.85 -12.45 31.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.29 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -25.48 33.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.925 0.393 . . . . 0.0 110.361 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.406 ' HA3' ' N ' ' A' ' 404' ' ' LYS . . . -76.41 -70.19 1.31 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.459 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.946 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 29.1 t . . . . . 0 CA--C 1.519 -0.247 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.718 ' HA ' HD12 ' A' ' 383' ' ' ILE . 33.5 mm -58.76 -29.7 40.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.471 ' HA ' HG12 ' A' ' 384' ' ' ILE . 4.0 mtpt -57.03 -33.19 66.95 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.019 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.535 ' O ' HG23 ' A' ' 386' ' ' VAL . 17.2 mttt -66.7 -38.05 85.97 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.196 0.522 . . . . 0.0 110.841 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.718 HD12 ' HA ' ' A' ' 380' ' ' ILE . 18.9 mt -60.5 -35.74 65.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.308 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.639 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -75.03 -44.65 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.592 178.53 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -58.08 -49.38 77.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.893 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.548 HG11 ' HB3' ' A' ' 423' ' ' LEU . 41.1 t -69.23 -46.09 78.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.079 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.16 -36.46 81.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.941 0.4 . . . . 0.0 110.502 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.82 -34.76 77.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.739 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -36.36 74.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.785 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.796 HG22 ' CD ' ' A' ' 419' ' ' GLU . 15.6 t -66.84 -46.75 84.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.063 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.407 ' HG3' ' N ' ' A' ' 392' ' ' TYR . 12.4 pt20 -61.79 -37.5 84.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.627 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 392' ' ' TYR . . . . . 0.407 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 15.3 t80 -72.4 -47.98 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.807 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.41 ' HB3' HD22 ' A' ' 416' ' ' LEU . 4.4 mt -60.73 -39.36 88.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 394' ' ' GLU . . . . . 0.406 ' OE1' HD11 ' A' ' 448' ' ' ILE . 47.9 tt0 -61.3 -40.66 94.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.751 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -31.83 73.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.737 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -68.79 -40.37 79.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.792 HG21 ' CG2' ' A' ' 448' ' ' ILE . 30.3 t -60.64 -40.13 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.784 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.58 -37.0 70.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.119 0.485 . . . . 0.0 110.371 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -83.57 -54.38 4.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.254 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.679 ' CE1' HD23 ' A' ' 412' ' ' LEU . 51.2 t80 -27.69 109.18 0.04 OUTLIER 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.023 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 401' ' ' VAL . 20.4 t -102.36 26.36 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.298 178.061 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.629 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -56.3 -175.91 0.25 Allowed Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.118 -179.269 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.496 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.66 48.25 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.819 -0.69 . . . . 0.0 111.511 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.444 ' HG2' ' CZ ' ' A' ' 409' ' ' TYR . 0.9 OUTLIER -53.5 -26.3 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.423 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 7.9 t -94.95 -15.48 23.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.552 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.454 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 9.2 t70 -77.44 142.29 39.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.78 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 46.2 mttm -61.71 -30.41 70.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.636 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.07 -29.08 70.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.728 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 24.3 t80 -67.77 -45.46 74.83 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.78 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.2 p-90 -72.73 -29.34 63.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.056 178.191 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.616 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.1 tp -69.54 -40.39 76.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.158 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.721 HD12 HD21 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -59.68 -46.96 87.49 Favored 'General case' 0 C--N 1.339 0.141 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.885 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.823 ' HG2' HD22 ' A' ' 452' ' ' LEU . 1.2 mt-10 -70.09 -31.52 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.521 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.6 OUTLIER -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.018 -179.181 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.49 -39.74 77.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.217 0.532 . . . . 0.0 109.896 178.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 1.067 HD12 HG23 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -60.6 -42.72 97.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.881 179.962 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.559 HG22 HD13 ' A' ' 421' ' ' LEU . 3.2 m -65.92 -32.72 74.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.689 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -47.21 84.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.569 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.796 ' CD ' HG22 ' A' ' 390' ' ' VAL . 0.0 OUTLIER -63.55 -34.55 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 0.4 OUTLIER -68.88 -41.2 78.66 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.916 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.559 HD13 HG22 ' A' ' 417' ' ' THR . 5.5 mp -70.75 -31.87 68.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.328 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 -46.55 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.943 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.548 ' HB3' HG11 ' A' ' 386' ' ' VAL . 3.1 pp -58.81 -30.7 67.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.743 0.306 . . . . 0.0 111.261 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -91.75 31.77 1.18 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.371 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.34 -17.58 8.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.446 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.4 m -66.59 137.87 24.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.792 0.33 . . . . 0.0 111.386 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -87.73 86.47 7.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 5.5 p -84.22 131.99 34.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.795 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -93.19 -76.38 1.33 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.532 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -131.61 44.52 1.2 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.415 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.412 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.9 mt-30 -106.99 92.54 4.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.825 0.345 . . . . 0.0 110.883 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -67.55 -40.39 84.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.989 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 76.6 p -58.66 -44.88 90.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.852 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.412 HG23 ' HB3' ' A' ' 431' ' ' GLN . 43.5 t -64.43 -39.89 87.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.981 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -58.88 -42.8 90.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -36.68 83.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.639 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.56 -40.61 95.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.547 ' HB3' HD13 ' A' ' 423' ' ' LEU . 0.0 OUTLIER -66.79 -44.3 81.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.9 mtpp -55.98 -35.25 66.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 110.629 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.05 -32.0 64.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.743 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.56 72.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.071 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.464 HG13 HD21 ' A' ' 420' ' ' LEU . 42.5 t -62.96 -39.21 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -38.56 85.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.517 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -35.45 80.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.353 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 1.067 HG23 HD12 ' A' ' 416' ' ' LEU . 2.5 mm -65.78 -31.2 52.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.707 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -44.45 85.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.442 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.62 -38.44 91.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.839 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.86 ' O ' HD12 ' A' ' 452' ' ' LEU . 15.9 mt -74.67 -36.29 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.878 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.573 HD12 HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.2 -51.64 68.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.675 -179.776 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.47 -33.99 77.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 0.0 110.098 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -59.65 -31.71 69.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.848 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.86 HD12 ' O ' ' A' ' 448' ' ' ILE . 0.4 OUTLIER -73.14 -36.61 66.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.448 179.265 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.21 -30.0 61.72 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.974 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -13.57 23.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.367 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -82.06 -26.26 33.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.171 0.51 . . . . 0.0 110.916 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.66 -97.97 0.74 Allowed Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.598 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.848 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.519 -0.232 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.868 ' O ' HG22 ' A' ' 383' ' ' ILE . 30.6 mm -58.67 -29.9 40.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.403 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.79 -33.26 66.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.865 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -65.82 -41.16 92.16 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.325 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.868 HG22 ' O ' ' A' ' 380' ' ' ILE . 5.4 tp -60.68 -32.41 51.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.573 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -75.02 -44.78 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.714 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.98 -49.36 75.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.882 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.462 ' O ' HG23 ' A' ' 390' ' ' VAL . 10.4 p -63.87 -37.34 79.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.861 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.4 tp -67.56 -37.73 83.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.67 -34.67 77.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.744 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -44.58 78.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 386' ' ' VAL . 29.0 t -63.25 -35.95 74.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.136 0.493 . . . . 0.0 110.384 179.334 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.32 -41.06 88.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.486 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.95 -42.87 99.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.303 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.637 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.0 OUTLIER -58.4 -38.08 76.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.447 179.501 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 394' ' ' GLU . . . . . 0.71 ' OE1' HD11 ' A' ' 448' ' ' ILE . 15.2 tt0 -59.37 -42.69 92.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.1 -41.1 82.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.779 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 49.3 mm-40 -69.27 -44.51 71.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.971 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.791 HG11 HG22 ' A' ' 448' ' ' ILE . 45.5 t -60.59 -33.45 54.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.532 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -57.01 -34.78 68.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.993 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.0 tt0 -89.99 -67.46 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.764 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.851 ' CD1' HD22 ' A' ' 412' ' ' LEU . 8.2 t80 43.4 111.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.805 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 9.8 m -95.76 23.6 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.157 178.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.526 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.69 -171.46 42.26 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.582 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.455 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.07 143.77 48.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.685 0.279 . . . . 0.0 111.666 -179.696 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.528 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.94 -25.56 30.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.214 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.05 0.37 37.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.436 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -92.14 149.5 21.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.34 . . . . 0.0 110.635 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.783 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.14 -30.16 70.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.852 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.82 -29.17 70.52 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.103 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.528 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.3 t80 -69.57 -45.56 68.41 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.783 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 4.8 p-90 -72.85 -30.99 64.45 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.961 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.619 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 36.6 tp -69.67 -38.4 77.03 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.471 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.851 HD22 ' CD1' ' A' ' 400' ' ' PHE . 11.2 tp -61.66 -47.34 85.81 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.86 ' CG ' HD13 ' A' ' 452' ' ' LEU . 24.7 mt-10 -70.41 -32.7 70.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.304 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.619 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mt-10 -64.01 -35.67 81.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.442 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 28.3 ttp -69.6 -40.66 76.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.653 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.835 HD21 HG21 ' A' ' 448' ' ' ILE . 1.9 mp -60.62 -45.74 92.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -33.45 75.11 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.643 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -59.41 -47.27 86.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.358 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -69.75 -38.11 76.67 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.501 HD13 HG13 ' A' ' 445' ' ' ILE . 27.9 tp -61.35 -39.47 90.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.247 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.34 -31.84 69.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.782 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -46.21 91.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.781 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.24 -35.07 77.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.824 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.12 -31.26 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.803 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.8 t -60.31 -20.79 60.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 22.7 t -66.49 116.77 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.087 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.54 113.72 25.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.959 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 7.4 t -107.87 133.21 52.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -96.24 34.64 4.82 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.482 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 108.69 69.94 0.67 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.426 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.662 ' HG2' HG23 ' A' ' 434' ' ' VAL . 3.0 tt0 -143.19 114.5 7.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.937 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -65.81 -35.27 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 42.2 t -60.14 -44.66 94.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.662 HG23 ' HG2' ' A' ' 431' ' ' GLN . 27.8 t -71.13 -42.89 75.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.995 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -67.78 -35.5 78.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.09 -35.26 76.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.853 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.13 76.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.136 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.0 OUTLIER -68.63 -43.86 75.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.935 179.971 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -59.04 -44.83 91.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.767 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -62.48 -36.28 82.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.645 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.42 76.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.002 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 438' ' ' ARG . 34.2 t -63.11 -45.9 97.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.051 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.91 -34.56 74.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.083 0.468 . . . . 0.0 110.322 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -63.18 -35.74 81.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.339 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.58 ' HA ' HD12 ' A' ' 448' ' ' ILE . 2.6 mm -66.13 -35.51 75.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.473 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -58.25 -47.78 82.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.089 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.63 -37.07 85.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.966 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.835 HG21 HD21 ' A' ' 416' ' ' LEU . 7.8 mt -74.78 -36.5 40.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.144 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.535 ' CD1' HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.39 -54.11 50.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.926 -179.473 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -38.62 91.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.354 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 451' ' ' LYS . . . . . 0.454 ' O ' ' HD2' ' A' ' 455' ' ' LYS . 3.7 mttm -57.87 -35.19 70.64 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.86 HD13 ' CG ' ' A' ' 413' ' ' GLU . 0.2 OUTLIER -66.46 -36.76 83.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.397 179.071 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.7 -29.91 70.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.789 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.71 -16.25 25.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.845 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.454 ' HD2' ' O ' ' A' ' 451' ' ' LYS . 0.3 OUTLIER -82.46 -22.6 35.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.797 0.332 . . . . 0.0 110.776 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.08 -79.77 0.67 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.374 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.401 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 96.7 p . . . . . 0 CA--C 1.518 -0.276 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.764 HG22 HD11 ' A' ' 384' ' ' ILE . 46.0 mm -58.65 -29.81 40.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 178.489 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.438 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.09 -33.35 67.21 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.052 -179.84 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 382' ' ' LYS . . . . . 0.705 ' O ' HG23 ' A' ' 386' ' ' VAL . 47.4 mttt -68.25 -38.21 81.55 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.099 0.476 . . . . 0.0 110.873 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.761 HD12 ' HA ' ' A' ' 380' ' ' ILE . 21.6 mt -60.54 -34.98 60.35 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.399 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.764 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.97 -44.72 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.426 178.615 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.04 -49.32 76.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.768 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.8 ' HB ' HD21 ' A' ' 423' ' ' LEU . 19.9 t -67.06 -39.34 83.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.012 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 4.2 tt -67.13 -35.65 80.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.474 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 388' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.2 tt0 -62.71 -34.72 77.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.672 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.02 -34.6 73.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.424 179.704 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 386' ' ' VAL . 32.6 t -67.7 -46.87 81.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.096 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 14.4 pt20 -59.46 -41.03 88.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.946 0.403 . . . . 0.0 110.538 179.888 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.37 -37.39 77.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.231 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.799 HD21 ' HG2' ' A' ' 415' ' ' MET . 0.4 OUTLIER -64.97 -38.66 91.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.381 179.484 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 394' ' ' GLU . . . . . 0.488 ' HB2' HD11 ' A' ' 448' ' ' ILE . 7.3 tt0 -59.11 -45.07 91.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.461 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -60.98 -33.52 73.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.631 179.562 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.25 -40.7 77.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.813 179.858 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.932 HG21 ' CG2' ' A' ' 448' ' ' ILE . 24.4 t -60.68 -33.27 54.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.472 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -28.51 64.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.174 0.512 . . . . 0.0 110.135 178.949 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 24.3 tt0 -91.69 -53.39 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.886 179.119 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.675 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 46.1 t80 -20.78 112.64 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.231 179.823 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.8 p -104.07 26.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.619 178.243 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.675 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -58.91 -177.66 0.93 Allowed Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.781 -0.724 . . . . 0.0 113.065 -179.309 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.518 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.62 48.22 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.834 -0.683 . . . . 0.0 111.543 -179.999 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -52.56 -27.15 15.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.319 179.355 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.5 -15.55 20.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.493 -179.707 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -74.52 144.17 44.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.763 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.1 OUTLIER -62.81 -30.83 71.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.813 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.09 70.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.803 179.565 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.518 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 41.2 t80 -68.36 -45.58 72.43 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.569 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.763 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -72.94 -29.37 63.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.949 177.921 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.62 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 20.2 tp -69.61 -38.43 77.26 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.14 177.943 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.733 HD12 HD21 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.69 -47.32 85.86 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.906 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.449 ' HG3' HD13 ' A' ' 452' ' ' LEU . 3.7 tt0 -70.63 -32.26 69.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.646 177.701 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.87 -38.97 93.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.198 -179.367 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.799 ' HG2' HD21 ' A' ' 393' ' ' LEU . 50.3 ttp -69.64 -44.79 69.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.339 . . . . 0.0 110.859 -179.931 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.876 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.49 -37.11 77.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.505 179.641 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.876 ' N ' HD12 ' A' ' 416' ' ' LEU . 1.2 t -70.26 -44.28 68.77 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 418' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -61.68 -38.61 88.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.726 0.298 . . . . 0.0 110.931 -179.627 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 18.0 pt-20 -72.27 -46.33 56.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.11 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.755 ' CB ' HG21 ' A' ' 445' ' ' ILE . 1.7 pp -66.61 -34.29 77.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.5 -38.44 89.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.937 179.249 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.89 -44.3 97.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.298 179.51 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.8 HD21 ' HB ' ' A' ' 386' ' ' VAL . 82.1 mt -67.06 -38.08 85.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.708 179.582 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.04 -26.47 65.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.009 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 4.3 p -96.8 38.33 1.23 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.931 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 10.9 p -88.92 133.53 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.45 98.68 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.8 t -114.22 129.55 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.947 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -158.46 100.06 0.19 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.462 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.21 49.89 54.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.458 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.504 ' O ' HG12 ' A' ' 434' ' ' VAL . 32.4 mt-30 -152.2 108.63 3.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.867 0.365 . . . . 0.0 110.926 179.936 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.69 -28.82 68.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.5 m -59.8 -44.93 93.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.724 -179.34 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 431' ' ' GLN . 10.8 p -72.44 -35.25 51.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 111.328 -179.588 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -42.44 94.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.803 0.335 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -69.29 -32.88 72.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 0.503 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -71.43 -45.23 63.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.199 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.2 ptt85 -68.36 -35.08 77.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.775 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -66.24 -35.79 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.793 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.6 -45.42 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.23 95.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 438' ' ' ARG . 24.5 t -63.33 -31.34 52.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.83 -46.7 62.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.98 179.774 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -67.01 -44.69 79.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.218 -179.796 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.755 HG21 ' CB ' ' A' ' 420' ' ' LEU . 2.0 pp -63.3 -31.08 51.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.98 0.419 . . . . 0.0 110.937 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.09 -44.62 91.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.584 179.692 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.13 77.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.284 -179.963 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.932 ' CG2' HG21 ' A' ' 397' ' ' VAL . 22.0 mt -73.3 -36.59 49.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.174 -179.9 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.57 -57.64 11.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.026 -179.768 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -33.18 74.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.744 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -31.88 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.976 0.417 . . . . 0.0 110.365 179.6 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.733 HD21 HD12 ' A' ' 412' ' ' LEU . 2.7 mt -77.61 -36.63 51.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.796 179.619 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -56.04 -30.01 61.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.769 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -90.35 -22.43 21.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.737 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -19.2 39.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.031 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.03 -98.9 0.14 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.483 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.89 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 10.7 p . . . . . 0 CA--C 1.518 -0.256 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.554 HG22 HD11 ' A' ' 384' ' ' ILE . 33.2 mm -58.6 -29.76 40.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.547 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.429 ' HA ' HG12 ' A' ' 384' ' ' ILE . 24.6 mttt -59.35 -33.32 71.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.811 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -68.09 -38.07 81.93 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.246 0.546 . . . . 0.0 110.764 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.571 HD12 HG13 ' A' ' 434' ' ' VAL . 40.1 mm -60.48 -33.95 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.477 178.945 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.557 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -74.94 -44.49 44.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.169 178.293 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -56.82 -45.98 81.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.696 179.688 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.453 HG13 ' N ' ' A' ' 387' ' ' LEU . 13.5 p -69.36 -44.16 80.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.695 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.941 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.3 OUTLIER -66.12 -35.11 79.62 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.745 179.87 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.81 -34.98 78.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.304 0.573 . . . . 0.0 109.526 178.784 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -67.16 -40.78 86.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.591 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.941 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -63.17 -35.62 72.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.817 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.22 -41.07 99.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.816 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -64.23 -44.96 90.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.515 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -58.69 -40.6 84.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.986 179.962 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -60.15 -39.44 86.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.944 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -36.24 82.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.132 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.48 -40.62 85.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.093 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.86 HG21 HG21 ' A' ' 448' ' ' ILE . 18.1 t -60.68 -39.19 80.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 179.891 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.65 -40.37 75.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.979 0.418 . . . . 0.0 110.388 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' C ' ' A' ' 400' ' ' PHE . 17.6 tt0 -77.34 -54.86 5.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.169 179.35 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.557 ' CE1' HD23 ' A' ' 412' ' ' LEU . 41.8 t80 -11.76 110.92 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.525 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.628 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.5 p -104.49 24.92 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.515 178.193 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.524 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -64.4 -169.05 1.71 Allowed Glycine 0 N--CA 1.442 -0.925 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.873 -179.347 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.59 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.86 143.55 48.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.351 -0.424 . . . . 0.0 111.253 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.629 ' HG2' HD23 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -52.79 -24.07 8.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.781 179.853 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 405' ' ' THR . . . . . 0.401 HG23 ' HD2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER -105.02 -5.03 21.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.521 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.563 ' OD2' ' HB3' ' A' ' 408' ' ' ALA . 24.3 t70 -77.84 156.13 30.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.788 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 41.0 mtmt -68.97 -32.87 72.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.292 179.587 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.563 ' HB3' ' OD2' ' A' ' 406' ' ' ASP . . . -62.83 -29.2 70.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 178.924 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 19.8 t80 -63.04 -45.23 93.23 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.827 -179.118 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.788 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.6 OUTLIER -72.62 -27.91 62.44 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 118.763 -1.175 . . . . 0.0 108.74 177.83 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.677 HD12 ' CE3' ' A' ' 410' ' ' TRP . 1.7 mp -66.48 -41.53 88.84 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.28 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.826 HD12 HD13 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -59.82 -46.78 88.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.813 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.403 ' CG ' ' CD2' ' A' ' 449' ' ' LEU . 2.1 tm-20 -70.23 -31.94 69.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.593 177.921 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.552 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.0 OUTLIER -63.49 -42.22 98.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.339 -179.059 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 4.1 mmt -69.53 -44.33 71.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.078 0.466 . . . . 0.0 110.622 179.622 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.571 HD21 HG21 ' A' ' 397' ' ' VAL . 4.3 mt -61.68 -44.34 97.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 23.7 m -62.58 -30.46 71.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 -179.93 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 418' ' ' LYS . . . . . 0.67 ' HA ' HD12 ' A' ' 421' ' ' LEU . 14.7 mttt -64.31 -43.39 94.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.062 0.458 . . . . 0.0 110.261 179.42 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.562 ' O ' HD23 ' A' ' 423' ' ' LEU . 1.0 OUTLIER -72.73 -37.78 67.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.991 179.178 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.912 ' HG ' HG13 ' A' ' 442' ' ' VAL . 0.3 OUTLIER -66.86 -50.51 62.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.385 -179.812 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.982 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.33 -31.5 68.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.986 -179.567 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 422' ' ' GLU . . . . . 0.982 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.8 OUTLIER -59.64 -46.34 89.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.781 0.324 . . . . 0.0 110.883 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.604 ' HG ' ' HB3' ' A' ' 441' ' ' ALA . 4.3 mm? -65.4 -31.02 71.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.991 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.07 -0.82 41.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.535 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 33.8 p -79.51 -37.25 37.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.825 0.345 . . . . 0.0 110.971 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 27.6 m -74.21 133.77 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.166 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -86.56 -22.22 26.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.069 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.5 t 43.53 85.52 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.525 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.21 46.98 1.64 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.449 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 144.92 52.57 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.465 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.737 ' HG2' HG23 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -164.14 95.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.86 0.362 . . . . 0.0 110.912 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -65.87 -33.93 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.867 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 27.9 t -59.15 -37.45 77.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.737 HG23 ' HG2' ' A' ' 431' ' ' GLN . 30.8 t -74.43 -41.9 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.088 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -44.25 93.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -67.47 -35.76 79.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.046 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 0.408 ' CB ' ' CG2' ' A' ' 383' ' ' ILE . . . -73.11 -45.12 58.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.471 -179.767 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.764 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.1 OUTLIER -66.17 -40.11 90.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.947 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -36.12 82.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.707 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.06 -42.82 62.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.811 179.784 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 441' ' ' ALA . . . . . 0.697 ' HB2' ' CD2' ' A' ' 387' ' ' LEU . . . -62.01 -45.56 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.912 HG13 ' HG ' ' A' ' 420' ' ' LEU . 43.2 t -65.11 -46.04 92.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.966 0.412 . . . . 0.0 110.813 179.823 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 8.7 m -61.97 -35.14 77.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.522 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 444' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.1 -38.03 89.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.389 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.671 ' HA ' HD12 ' A' ' 448' ' ' ILE . 1.5 mp -67.08 -31.32 52.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.485 ' HA ' HD12 ' A' ' 449' ' ' LEU . 6.8 tp-100 -63.05 -45.79 90.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.712 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.5 -37.62 85.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.86 HG21 HG21 ' A' ' 397' ' ' VAL . 10.1 mt -70.34 -36.41 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.805 179.699 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 446' ' ' GLN . 20.0 mt -57.19 -50.22 73.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.63 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.42 -41.85 75.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 110.123 179.318 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.83 -30.04 65.44 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.544 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.826 HD13 HD12 ' A' ' 412' ' ' LEU . 11.4 tp -71.25 -36.64 71.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.323 179.249 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -56.31 -29.93 61.9 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.587 179.45 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -89.91 -17.13 28.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.904 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -22.41 35.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.717 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.09 -81.61 0.43 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.151 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.629 HD23 ' HG2' ' A' ' 404' ' ' LYS . 2.5 pp . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.947 179.851 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 CA--C 1.521 -0.149 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.481 HG22 HD11 ' A' ' 384' ' ' ILE . 3.2 mt -58.82 -30.11 41.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.609 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.444 ' HA ' HG12 ' A' ' 384' ' ' ILE . 6.5 mmmt -57.04 -33.23 67.01 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.867 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -38.09 83.69 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.154 0.502 . . . . 0.0 110.808 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.798 HG21 ' HB1' ' A' ' 437' ' ' ALA . 39.4 mm -60.44 -34.33 57.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.445 178.884 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.481 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.86 -44.72 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.396 178.517 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -57.37 -49.1 77.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.573 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.798 HG11 ' HG ' ' A' ' 423' ' ' LEU . 78.1 t -65.97 -40.74 88.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.824 179.634 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.925 ' O ' HG12 ' A' ' 390' ' ' VAL . 3.2 tt -66.01 -35.06 79.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.906 0.384 . . . . 0.0 110.622 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -34.97 78.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.905 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -67.75 -39.54 84.17 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.604 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.925 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -64.48 -35.57 74.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.483 179.635 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -41.02 97.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.349 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -67.81 -46.52 71.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.491 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.91 ' O ' HG23 ' A' ' 397' ' ' VAL . 42.7 mt -62.11 -37.97 87.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.487 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -37.36 79.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.645 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -64.04 -42.39 97.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.606 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -69.04 -40.19 78.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.715 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.91 HG23 ' O ' ' A' ' 393' ' ' LEU . 22.1 t -60.6 -36.71 72.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.672 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.61 -35.75 66.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.175 0.512 . . . . 0.0 110.107 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -90.07 -66.83 0.89 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.813 178.998 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.924 ' CE1' HD13 ' A' ' 412' ' ' LEU . 9.6 t80 31.21 108.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 179.292 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.59 ' O ' HG12 ' A' ' 401' ' ' VAL . 17.4 t -95.49 25.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.165 178.177 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.564 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -87.03 -174.83 49.15 Favored Glycine 0 N--CA 1.442 -0.914 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.683 -179.719 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.7 OUTLIER -134.21 143.69 48.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.603 -0.299 . . . . 0.0 111.755 -179.787 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.502 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.1 -25.62 32.55 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.083 179.151 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.4 m -105.33 14.51 28.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.223 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.75 151.84 24.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.763 179.831 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.739 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.1 -30.26 70.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 -179.827 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 408' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -64.4 -29.28 70.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 179.828 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.502 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 3.5 t80 -71.17 -45.67 62.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.369 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.739 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.1 p-90 -73.07 -29.62 63.09 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.849 177.908 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -69.65 -40.75 76.31 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.768 177.994 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.924 HD13 ' CE1' ' A' ' 400' ' ' PHE . 1.6 tp -61.97 -46.97 86.93 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.078 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.37 -32.2 69.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.758 177.961 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.58 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.3 mm-40 -63.61 -38.66 91.95 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.91 -179.485 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.454 ' CE ' HD22 ' A' ' 393' ' ' LEU . 42.9 ttp -69.6 -41.59 75.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.994 0.426 . . . . 0.0 110.28 179.332 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.43 HD11 HG22 ' A' ' 445' ' ' ILE . 10.3 tp -62.29 -45.1 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.684 179.661 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.44 HG22 HD13 ' A' ' 421' ' ' LEU . 2.0 m -62.73 -32.59 73.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.712 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -61.46 -42.82 99.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.537 179.662 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -67.49 -46.4 73.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.282 179.614 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.938 HD21 HG22 ' A' ' 442' ' ' VAL . 2.7 tm? -59.87 -38.53 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.441 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.44 HD13 HG22 ' A' ' 417' ' ' THR . 1.9 mp -64.88 -31.8 73.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.56 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.07 -46.27 88.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.798 ' HG ' HG11 ' A' ' 386' ' ' VAL . 37.3 mt -65.34 -33.99 77.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.869 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -5.18 54.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.3 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 32.2 t -89.37 10.64 21.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.609 0.242 . . . . 0.0 111.374 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 30.0 t -93.54 115.6 32.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.855 0.36 . . . . 0.0 110.912 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -82.14 87.69 6.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.905 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 9.9 t -73.79 149.81 41.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.845 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -127.66 41.31 1.61 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.518 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.11 -27.47 4.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.528 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.652 ' CG ' HG23 ' A' ' 434' ' ' VAL . 47.7 tp60 -58.53 92.48 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 0.0 111.043 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -66.44 -29.71 69.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.1 m -57.74 -44.15 85.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.984 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.652 HG23 ' CG ' ' A' ' 431' ' ' GLN . 29.5 t -64.86 -36.88 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.061 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -62.18 -40.91 97.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.858 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -36.13 77.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 0.798 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -70.87 -45.19 64.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.105 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 442' ' ' VAL . 4.4 ptt180 -69.22 -35.06 75.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -65.46 -39.58 92.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.513 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.27 -38.0 89.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.566 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.0 -42.23 98.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.801 179.812 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.938 HG22 HD21 ' A' ' 420' ' ' LEU . 11.8 t -62.97 -32.51 56.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.833 179.83 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.67 -40.59 72.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.777 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -72.97 -44.59 60.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.856 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.704 HD12 ' N ' ' A' ' 446' ' ' GLN . 2.8 pp -64.66 -31.09 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.076 0.465 . . . . 0.0 110.624 179.575 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.704 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -66.15 -44.03 85.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.449 179.7 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.3 -37.35 80.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.948 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.501 HG22 HG11 ' A' ' 397' ' ' VAL . 29.7 mt -70.99 -36.51 63.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.863 179.737 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -53.22 60.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.942 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.99 -41.07 91.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.466 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.79 -30.6 65.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.935 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.59 ' CD1' HD23 ' A' ' 412' ' ' LEU . 4.1 tp -70.37 -36.48 74.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.334 179.124 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -29.73 61.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.598 179.565 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.5 -12.19 30.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.475 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -25.55 33.53 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.896 0.379 . . . . 0.0 110.484 179.708 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.39 -73.7 1.15 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.395 179.936 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.416 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.852 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.19 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.712 HG22 HD11 ' A' ' 384' ' ' ILE . 31.8 mm -58.75 -29.93 41.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.773 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.45 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -56.92 -33.27 66.78 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.583 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.34 -37.93 81.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.19 0.519 . . . . 0.0 110.473 179.473 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.481 HG21 ' HB1' ' A' ' 437' ' ' ALA . 19.4 mm -60.31 -33.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.441 178.997 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.712 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.88 -44.68 44.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.471 178.493 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.42 -49.36 77.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.686 179.898 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.887 HG11 ' HB3' ' A' ' 423' ' ' LEU . 77.6 t -65.94 -43.95 92.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.753 179.673 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.44 -35.8 78.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.898 0.38 . . . . 0.0 110.505 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 388' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 4.5 mt-10 -62.79 -34.92 78.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.232 0.539 . . . . 0.0 109.637 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.25 -34.52 72.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.569 179.669 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 386' ' ' VAL . 36.8 t -62.42 -46.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.455 -179.714 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.8 pt20 -64.32 -36.34 83.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -34.99 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.188 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.897 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -68.0 -37.91 82.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.261 179.429 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -39.1 79.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.615 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -39.2 80.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.458 179.659 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.4 -44.58 71.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.223 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 393' ' ' LEU . 21.8 t -60.82 -47.49 93.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.414 -179.584 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.66 -29.91 64.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.696 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -87.57 -57.63 2.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.975 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.575 ' CE1' ' HG ' ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.76 128.75 36.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.905 -179.853 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 402' ' ' GLY . 29.4 m -124.37 40.55 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.414 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.526 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.97 -163.44 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.002 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.24 143.67 49.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.01 0.433 . . . . 0.0 111.44 -179.354 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.461 ' HA ' ' CE1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.23 -24.48 27.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.861 -179.888 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.69 14.03 24.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.352 -179.797 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.546 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t0 -95.62 154.07 17.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.37 . . . . 0.0 111.171 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -71.36 -43.48 66.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.704 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.94 -33.1 74.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.535 179.682 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.53 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 4.0 t80 -67.59 -44.24 78.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.287 179.634 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.432 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -56.01 -48.44 75.9 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.43 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -60.11 -37.96 81.58 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.111 176.968 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.575 ' HG ' ' CE1' ' A' ' 400' ' ' PHE . 0.1 OUTLIER -59.4 -47.73 84.33 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.483 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -71.02 -32.64 69.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.53 177.432 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.16 -46.5 83.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 114.992 -1.003 . . . . 0.0 111.644 -179.312 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.533 ' HE2' HD13 ' A' ' 412' ' ' LEU . 5.5 ptt? -64.56 -39.68 94.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.744 0.306 . . . . 0.0 110.856 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.719 HD23 HD22 ' A' ' 393' ' ' LEU . 3.4 tm? -60.69 -38.41 84.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.926 0.393 . . . . 0.0 110.708 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.527 ' O ' HD13 ' A' ' 421' ' ' LEU . 1.3 m -67.54 -38.53 84.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.114 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.09 -40.92 82.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.004 -179.853 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.447 ' HG3' HD11 ' A' ' 393' ' ' LEU . 0.9 OUTLIER -63.5 -46.34 86.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.013 0.435 . . . . 0.0 110.136 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.811 ' CD2' HG22 ' A' ' 442' ' ' VAL . 2.7 tm? -62.14 -37.34 84.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.442 179.422 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 417' ' ' THR . 7.3 mp -70.5 -31.8 69.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -46.39 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.141 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.887 ' HB3' HG11 ' A' ' 386' ' ' VAL . 4.2 pp -67.91 -30.76 70.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.12 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 424' ' ' ASP . . . . . 0.807 ' N ' HD12 ' A' ' 423' ' ' LEU . 4.1 t70 -83.92 11.33 7.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.595 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 26.9 t -100.27 -19.02 16.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.682 0.277 . . . . 0.0 111.359 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 426' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 423' ' ' LEU . 29.8 m -66.61 137.84 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.903 0.382 . . . . 0.0 111.167 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.86 149.04 29.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.931 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -148.06 118.08 7.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.927 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -78.52 -50.89 5.86 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.985 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -172.22 35.97 0.15 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.421 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 431' ' ' GLN . . . . . 0.438 ' CD ' HG23 ' A' ' 434' ' ' VAL . 0.7 OUTLIER -97.28 102.59 14.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.875 0.369 . . . . 0.0 110.895 -179.968 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -60.14 -30.53 69.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.886 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -44.86 92.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.857 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.438 HG23 ' CD ' ' A' ' 431' ' ' GLN . 23.4 t -75.11 -42.48 44.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.985 179.93 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -63.08 -39.68 95.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.821 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 436' ' ' GLN . . . . . 0.412 ' HA ' ' HG2' ' A' ' 439' ' ' LYS . 2.5 tt0 -68.08 -37.58 81.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 0.481 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.08 -34.53 66.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.224 -179.867 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.442 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.1 OUTLIER -69.83 -44.53 69.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.799 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 439' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 436' ' ' GLN . 0.0 OUTLIER -64.65 -31.5 72.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 110.509 179.661 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 440' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 8.7 tp10 -65.89 -40.06 91.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.52 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.58 92.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.631 179.7 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.811 HG22 ' CD2' ' A' ' 420' ' ' LEU . 12.3 t -62.95 -30.88 50.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.772 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -45.67 65.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.944 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -44.14 96.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.533 HG12 ' HA ' ' A' ' 442' ' ' VAL . 34.3 pt -64.8 -31.22 52.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.043 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.435 ' N ' HG13 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -62.8 -40.95 98.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.223 179.733 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 447' ' ' ALA . . . . . 0.5 ' HB1' ' HZ1' ' A' ' 451' ' ' LYS . . . -66.51 -35.63 80.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.36 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.86 ' CG2' HG21 ' A' ' 397' ' ' VAL . 19.3 mt -74.8 -36.67 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.665 179.489 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.61 -47.54 81.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.626 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.2 -40.95 90.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.302 179.477 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 451' ' ' LYS . . . . . 0.5 ' HZ1' ' HB1' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -57.79 -30.11 65.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.086 0.47 . . . . 0.0 109.894 178.956 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.793 ' HG ' HG13 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -76.25 -36.73 58.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.416 179.392 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -41.53 93.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -78.96 -20.99 47.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.186 -179.96 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.411 ' HE3' HG12 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -82.42 -19.97 37.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.33 -88.44 0.35 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.478 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.516 -0.332 0 CA-C-O 120.653 0.263 . . . . 0.0 111.611 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 380' ' ' ILE . . . . . 0.709 HG22 HD11 ' A' ' 384' ' ' ILE . 3.0 mp -58.66 -29.53 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.704 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 381' ' ' LYS . . . . . 0.457 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.8 -33.4 66.63 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.796 179.838 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -68.32 -37.97 81.08 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.221 0.534 . . . . 0.0 110.505 179.606 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 383' ' ' ILE . . . . . 0.857 HD11 HG13 ' A' ' 434' ' ' VAL . 48.6 mt -60.45 -33.96 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.408 178.827 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 384' ' ' ILE . . . . . 0.709 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.95 -44.67 44.51 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.194 178.424 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -59.49 -49.34 78.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.602 179.721 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 386' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 390' ' ' VAL . 13.7 p -63.83 -35.45 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.368 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.9 tt -67.44 -34.29 76.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.262 179.454 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 388' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 0.3 OUTLIER -62.76 -35.15 78.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.601 179.017 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -35.43 73.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.569 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 390' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 386' ' ' VAL . 32.9 t -69.25 -46.82 76.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 388' ' ' GLU . 14.8 pt20 -58.36 -37.99 76.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.661 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -67.19 -42.86 83.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.435 179.556 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 393' ' ' LEU . . . . . 0.819 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -64.34 -37.92 89.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.332 179.368 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -39.16 81.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.542 179.653 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -63.12 -43.22 99.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.46 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.22 -42.07 76.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.492 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 397' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 393' ' ' LEU . 50.7 t -60.63 -32.17 50.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.398 179.472 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.7 -40.04 86.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.973 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.406 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.9 tt0 -86.51 -68.77 0.72 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.846 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.824 ' CD1' HD22 ' A' ' 412' ' ' LEU . 4.5 t80 57.13 144.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.16 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 401' ' ' VAL . . . . . 0.529 ' O ' HG12 ' A' ' 401' ' ' VAL . 11.9 t -125.98 21.62 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.916 178.701 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 402' ' ' GLY . . . . . 0.601 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -110.93 179.37 20.02 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.472 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 403' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.34 151.43 51.23 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.363 -0.419 . . . . 0.0 111.713 -179.618 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 404' ' ' LYS . . . . . 0.555 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.5 -31.91 25.58 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.128 179.233 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 8.9 t -97.2 15.67 22.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.196 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 406' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 1.8 t70 -115.23 155.06 27.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.848 0.356 . . . . 0.0 110.959 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 407' ' ' LYS . . . . . 0.79 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 4.0 mtmp? -61.72 -30.04 70.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.891 179.742 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.83 -29.24 70.58 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 409' ' ' TYR . . . . . 0.555 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 10.7 t80 -70.55 -45.81 64.77 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -178.61 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 410' ' ' TRP . . . . . 0.79 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -72.94 -29.12 62.86 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 118.804 -1.158 . . . . 0.0 108.888 177.979 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 411' ' ' LEU . . . . . 0.592 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 33.3 tp -69.59 -38.66 77.43 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.258 178.091 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.824 HD22 ' CD1' ' A' ' 400' ' ' PHE . 11.6 tp -62.15 -47.17 85.75 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.796 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.49 -32.14 69.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.732 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 414' ' ' GLU . . . . . 0.592 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.62 -46.59 85.04 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -178.982 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 415' ' ' MET . . . . . 0.583 ' HG3' HD12 ' A' ' 416' ' ' LEU . 2.5 ptt? -64.47 -38.72 92.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 110.272 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 416' ' ' LEU . . . . . 0.643 HD13 ' O ' ' A' ' 412' ' ' LEU . 8.7 mp -68.88 -37.17 78.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.632 179.233 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.449 ' HA ' HD23 ' A' ' 420' ' ' LEU . 81.4 m -67.15 -35.67 80.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -179.257 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 418' ' ' LYS . . . . . 0.463 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.1 OUTLIER -72.16 -34.54 68.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.573 0.225 . . . . 0.0 111.594 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 419' ' ' GLU . . . . . 0.753 ' OE1' HD22 ' A' ' 393' ' ' LEU . 9.0 pt-20 -72.2 -41.99 66.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.675 0.274 . . . . 0.0 111.043 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 420' ' ' LEU . . . . . 0.578 HD11 HD12 ' A' ' 421' ' ' LEU . 1.2 pp -67.49 -38.19 83.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.822 0.344 . . . . 0.0 110.755 179.941 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 421' ' ' LEU . . . . . 0.578 HD12 HD11 ' A' ' 420' ' ' LEU . 0.6 OUTLIER -68.32 -33.24 73.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.711 179.807 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -40.3 95.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.778 179.869 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -31.9 65.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.801 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -31.47 72.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.804 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 40.4 t -59.63 -26.47 65.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 40.6 t -66.63 126.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.23 176.43 7.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 3.9 t -162.59 160.28 25.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.864 179.968 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -146.87 85.91 0.17 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 65.49 28.26 73.4 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.481 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -106.81 94.47 5.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.804 0.335 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.99 -33.65 72.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -39.62 94.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.881 179.92 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 434' ' ' VAL . . . . . 0.857 HG13 HD11 ' A' ' 383' ' ' ILE . 24.5 t -76.04 -46.17 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.104 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.04 -40.32 95.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.842 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -69.32 -35.18 75.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.935 179.907 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 437' ' ' ALA . . . . . 0.52 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.2 -45.18 57.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.456 -179.738 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 438' ' ' ARG . . . . . 0.415 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -67.55 -40.02 84.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.884 -179.87 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.46 -44.87 85.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.026 0.441 . . . . 0.0 110.355 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -61.52 -31.6 71.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.285 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.28 -38.8 91.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.876 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 442' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 438' ' ' ARG . 26.8 t -62.64 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 443' ' ' CYS . . . . . 0.645 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.3 m -60.7 -30.01 69.68 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 444' ' ' LYS . . . . . 0.409 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.55 -41.6 98.43 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.769 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 445' ' ' ILE . . . . . 0.602 ' N ' HD13 ' A' ' 445' ' ' ILE . 0.6 OUTLIER -73.67 -35.26 43.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.508 0.671 . . . . 0.0 109.821 178.669 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 446' ' ' GLN . . . . . 0.645 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.4 OUTLIER -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.285 179.438 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.47 -40.45 86.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.121 179.699 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 448' ' ' ILE . . . . . 0.568 HG22 HG11 ' A' ' 397' ' ' VAL . 10.1 mt -72.75 -36.15 51.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.21 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -41.54 78.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.027 -179.198 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.5 -42.77 67.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -29.97 65.62 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.612 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.511 ' CG ' HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -71.32 -36.64 71.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.677 179.349 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.16 -29.86 61.4 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.41 -8.92 26.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.824 -179.809 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 452' ' ' LEU . 0.3 OUTLIER -82.52 -26.0 32.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 110.872 179.866 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -83.65 -73.57 1.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.276 -179.999 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.865 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 112.57 -0.212 . . . . 0.0 112.57 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.5 m -152.72 149.54 22.56 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.726 0.298 . . . . 0.0 110.926 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -69.11 -46.23 1.59 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.612 2.208 . . . . 0.0 112.274 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 55.91 172.74 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.05 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -114.22 156.92 23.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.81 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 61.9 104.73 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.432 ' HB3' ' HD2' ' A' ' 378' ' ' PRO . 59.2 Cg_exo -52.39 -174.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.65 2.233 . . . . 0.0 112.198 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.432 ' HD2' ' HB3' ' A' ' 377' ' ' PRO . 61.4 Cg_endo -80.59 -50.1 0.06 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.358 2.039 . . . . 0.0 113.289 -179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 56.3 p -74.29 -26.16 60.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.676 0.274 . . . . 0.0 111.485 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.654 HG22 HD11 ' A' ' 384' ' ' ILE . 37.7 mm -58.68 -29.75 40.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.492 ' HA ' HG12 ' A' ' 384' ' ' ILE . 30.4 mttp -56.71 -33.23 66.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.688 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.0 OUTLIER -67.18 -37.95 84.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.078 0.466 . . . . 0.0 110.773 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.44 -34.71 58.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.483 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.654 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.9 -44.68 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.316 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.31 -43.72 88.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.279 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 382' ' ' LYS . 42.5 t -70.31 -42.91 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.63 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.911 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -66.09 -35.09 79.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 179.657 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.86 -34.96 78.45 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -40.85 87.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.548 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.911 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -63.59 -35.54 73.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -40.97 98.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.513 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -70.44 -35.53 73.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.504 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.76 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.9 OUTLIER -65.22 -38.56 90.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.516 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.66 -46.88 87.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.543 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.96 -32.52 73.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.603 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -38.25 78.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.935 HG21 ' CG2' ' A' ' 448' ' ' ILE . 21.7 t -60.69 -41.98 90.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.858 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -55.63 -34.55 65.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.02 0.438 . . . . 0.0 110.468 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -84.45 -54.34 4.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.153 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.597 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.8 t80 -27.42 112.55 0.06 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.001 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.9 p -105.13 26.81 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.53 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.597 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -57.64 -170.22 0.18 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.173 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.95 143.88 48.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.217 -0.492 . . . . 0.0 111.486 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -30.56 3.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.068 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.8 t -115.48 15.77 16.68 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.485 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 0.3 OUTLIER -83.11 150.49 26.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.871 0.367 . . . . 0.0 110.859 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.534 ' O ' HD23 ' A' ' 411' ' ' LEU . 9.8 mmtm -63.41 -30.66 71.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.213 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -73.17 -38.86 66.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.967 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.535 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 16.7 t80 -60.12 -44.36 94.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.566 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.462 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -58.92 -48.82 80.1 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.653 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.587 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -64.27 -38.05 89.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.746 ' O ' HD12 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -59.58 -47.56 85.08 Favored 'General case' 0 CA--C 1.523 -0.089 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -32.64 69.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.223 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.587 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.18 -46.4 84.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.233 -179.679 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.717 ' SD ' HD21 ' A' ' 393' ' ' LEU . 17.3 ptp -62.85 -40.37 97.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.816 0.341 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 412' ' ' LEU . 1.3 mt -63.33 -48.15 79.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.449 . . . . 0.0 110.541 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.7 m -64.82 -30.39 71.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -62.19 -47.3 85.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.129 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.453 ' OE2' HG23 ' A' ' 390' ' ' VAL . 3.8 pt-20 -63.58 -34.81 78.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.027 0.442 . . . . 0.0 110.14 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.921 HD23 HD11 ' A' ' 423' ' ' LEU . 0.4 OUTLIER -69.01 -33.94 74.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.037 179.217 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.4 mp -70.34 -31.87 69.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.995 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.44 -46.38 60.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.814 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.921 HD11 HD23 ' A' ' 420' ' ' LEU . 4.5 pp -68.47 -30.82 69.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.96 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 424' ' ' ASP . . . . . 0.677 ' N ' HD12 ' A' ' 423' ' ' LEU . 15.6 t70 -92.68 29.74 1.7 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.217 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.3 t -109.24 -17.16 13.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.958 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 13.5 m -66.59 137.34 25.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 427' ' ' GLU . . . . . 0.49 ' O ' HG22 ' A' ' 428' ' ' THR . 0.3 OUTLIER -84.12 -46.75 11.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.947 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 427' ' ' GLU . 14.8 t 45.47 -167.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.358 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -169.65 -51.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.577 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.94 36.18 2.1 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.494 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.502 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.9 OUTLIER -103.84 103.27 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.906 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.5 -39.69 85.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -40.95 86.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.502 HG23 ' HB3' ' A' ' 431' ' ' GLN . 39.1 t -69.8 -46.28 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.165 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -39.33 83.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.012 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -69.15 -45.12 70.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.141 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -69.11 -37.58 78.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.291 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.856 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.0 OUTLIER -63.86 -44.55 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.052 -179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 34.1 tttp -67.96 -43.17 79.64 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.197 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -64.08 -39.41 94.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.1 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.59 86.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.22 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.888 HG22 HD21 ' A' ' 420' ' ' LEU . 20.3 t -62.64 -35.45 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.86 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 6.8 m -63.08 -36.05 82.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.436 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -64.39 -41.71 96.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.706 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.92 HG21 HD12 ' A' ' 420' ' ' LEU . 2.2 mp -63.36 -31.17 51.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -41.73 90.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.691 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.19 91.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.071 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.935 ' CG2' HG21 ' A' ' 397' ' ' VAL . 34.0 mt -73.61 -36.53 47.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.142 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.613 HD12 HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.5 -44.76 85.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.971 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.12 -40.93 67.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.852 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -30.93 66.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 110.067 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.545 HD11 HD12 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -77.58 -36.64 51.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.565 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -56.15 -30.0 61.55 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.805 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 10.5 pttt -90.37 -16.58 28.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.266 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -82.46 -23.5 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.668 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.57 -91.87 0.23 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.478 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.873 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.422 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 1.1 m -178.98 -61.62 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 120.632 0.253 . . . . 0.0 110.939 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 373' ' ' PRO . . . . . 0.422 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 57.3 Cg_endo -71.28 90.31 0.68 Allowed 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.505 2.136 . . . . 0.0 112.294 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -82.9 -33.12 26.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 62.33 90.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 1.2 p -147.11 119.01 4.71 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.745 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.404 ' HG2' HG13 ' A' ' 380' ' ' ILE . 42.0 Cg_exo -58.6 179.84 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.489 2.126 . . . . 0.0 112.298 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -89.29 -17.23 1.94 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.975 2.45 . . . . 0.0 113.358 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 19.9 m -103.6 -23.25 13.49 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.837 ' HA ' HD12 ' A' ' 383' ' ' ILE . 36.8 mm -58.65 -30.06 40.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.41 ' HA ' HG12 ' A' ' 384' ' ' ILE . 10.0 mmtp -56.8 -33.26 66.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -68.38 -39.85 81.61 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 111.218 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 1.019 HG21 ' HB1' ' A' ' 437' ' ' ALA . 4.4 mt -60.6 -31.79 49.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.673 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.72 HD11 HG22 ' A' ' 380' ' ' ILE . 0.4 OUTLIER -74.77 -44.3 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.44 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.16 178.53 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -56.37 -46.19 80.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.279 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.418 ' O ' HG23 ' A' ' 390' ' ' VAL . 96.6 t -68.44 -37.3 77.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.138 178.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 383' ' ' ILE . 0.2 OUTLIER -67.52 -35.19 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.256 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -62.8 -35.0 78.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.67 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -38.81 88.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.285 179.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 386' ' ' VAL . 24.2 t -69.74 -35.89 67.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.635 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -40.87 83.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.655 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -40.77 84.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.456 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.868 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -64.82 -40.99 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.498 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -59.86 -35.33 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -49.2 74.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -69.25 -45.11 70.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.99 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.902 HG11 HD11 ' A' ' 452' ' ' LEU . 23.6 t -61.38 -32.3 52.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 110.542 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -56.66 -37.05 70.26 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.239 0.543 . . . . 0.0 109.861 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -86.73 -67.7 0.8 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.671 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.896 ' CD1' HD22 ' A' ' 412' ' ' LEU . 4.0 t80 58.92 142.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.142 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.596 ' O ' HG12 ' A' ' 401' ' ' VAL . 18.0 t -123.92 20.68 4.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.093 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.528 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -115.89 178.57 17.62 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.402 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.458 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -134.19 157.03 47.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.884 0.373 . . . . 0.0 111.603 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.604 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.5 -31.71 56.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.661 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.6 t -89.77 9.48 27.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.791 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.458 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 1.8 m-20 -115.09 164.81 13.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.336 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.731 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.8 mmtm -69.66 -29.87 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.482 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -62.54 -29.23 70.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.579 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.604 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 22.9 t80 -71.64 -45.89 60.68 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.129 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.731 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.9 OUTLIER -73.14 -31.59 64.37 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.716 177.653 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.3 tp -67.8 -38.41 83.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.046 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.896 HD22 ' CD1' ' A' ' 400' ' ' PHE . 21.3 tp -60.85 -47.28 87.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -70.67 -32.02 69.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.795 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.57 -46.21 86.95 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.008 -179.112 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.613 ' CE ' HD12 ' A' ' 412' ' ' LEU . 8.2 ptt? -64.49 -37.56 87.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.977 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.632 ' O ' HD12 ' A' ' 416' ' ' LEU . 5.0 tp -65.95 -37.19 85.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.253 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 29.8 m -62.53 -40.35 96.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.888 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -60.52 -47.31 86.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.854 0.359 . . . . 0.0 110.489 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.717 ' OE1' HD13 ' A' ' 393' ' ' LEU . 14.7 pt-20 -72.17 -35.83 69.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.2 0.524 . . . . 0.0 109.809 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 1.044 HD12 HD12 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -61.97 -39.56 92.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.979 179.162 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.574 ' N ' HD23 ' A' ' 420' ' ' LEU . 1.7 tp -70.72 -31.79 68.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.073 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.04 -46.52 89.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.193 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.9 HD13 ' HB3' ' A' ' 441' ' ' ALA . 4.0 pp -74.45 -30.97 62.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -98.81 30.95 3.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.859 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.2 t -108.25 -16.01 14.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 5.6 m -66.53 127.34 27.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.864 0.364 . . . . 0.0 111.123 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -84.79 -41.73 15.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.9 p 55.89 -174.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.021 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -178.05 50.64 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.22 -28.92 4.21 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.454 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.757 ' HG2' HG23 ' A' ' 434' ' ' VAL . 0.3 OUTLIER -60.17 92.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.31 -35.61 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 20.5 p -61.81 -38.71 89.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.757 HG23 ' HG2' ' A' ' 431' ' ' GLN . 31.0 t -76.07 -36.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.056 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -40.99 94.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.88 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -69.22 -36.69 77.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 1.019 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.21 -45.1 58.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.417 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 439' ' ' LYS . 0.0 OUTLIER -65.17 -39.77 93.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.936 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 439' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 438' ' ' ARG . 0.0 OUTLIER -63.99 -43.42 95.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.601 179.818 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -32.31 71.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.696 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.9 ' HB3' HD13 ' A' ' 423' ' ' LEU . . . -66.9 -45.45 77.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.194 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.617 ' HA ' HD11 ' A' ' 445' ' ' ILE . 23.2 t -62.89 -30.78 50.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.111 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 4.0 t -67.35 -40.64 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.917 0.389 . . . . 0.0 110.48 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -44.73 78.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.087 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 1.044 HD12 HD12 ' A' ' 420' ' ' LEU . 9.4 pt -65.35 -31.23 52.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.916 0.388 . . . . 0.0 110.873 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.18 -47.78 84.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.725 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.67 80.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.819 HD12 ' HA ' ' A' ' 445' ' ' ILE . 21.4 mt -66.88 -36.6 77.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.718 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.45 -51.52 69.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.675 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -61.93 -30.47 70.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 110.336 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.39 75.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.075 0.464 . . . . 0.0 109.992 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.902 HD11 HG11 ' A' ' 397' ' ' VAL . 4.9 mp -70.81 -36.8 73.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.287 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -56.16 -29.84 61.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.187 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -101.19 -16.57 16.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.544 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -22.23 35.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.709 0.29 . . . . 0.0 110.95 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.36 -86.39 0.61 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.381 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.881 179.943 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.449 -0.261 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 90.7 p -82.52 144.48 49.43 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.669 0.271 . . . . 0.0 110.879 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -82.19 51.39 3.77 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.732 2.288 . . . . 0.0 112.58 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 52.2 39.94 27.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.866 0.365 . . . . 0.0 111.105 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 63.27 -79.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.889 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.94 113.63 57.78 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.742 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.438 ' HB2' HG12 ' A' ' 380' ' ' ILE . 76.2 Cg_exo -49.98 170.12 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.542 2.162 . . . . 0.0 112.47 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.88 -52.21 1.36 Allowed 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.916 2.411 . . . . 0.0 113.231 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.7 p -74.32 -27.29 60.63 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.9 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.8 mm -58.65 -29.76 40.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 2.1 mmpt? -56.71 -32.97 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.103 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -66.1 -41.98 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.941 0.401 . . . . 0.0 111.529 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.9 HG22 ' O ' ' A' ' 380' ' ' ILE . 7.8 tp -60.57 -31.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.547 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.693 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.91 -44.82 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.696 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -58.56 -49.35 77.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.809 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.452 HG13 ' N ' ' A' ' 387' ' ' LEU . 11.9 p -64.1 -42.89 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.452 ' N ' HG13 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -65.56 -33.5 76.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.681 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.87 -34.82 78.18 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.947 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.15 -43.38 87.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.487 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.71 HG13 ' OE2' ' A' ' 419' ' ' GLU . 28.0 t -61.97 -35.97 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.853 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.01 -41.07 97.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.808 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -68.27 -42.2 79.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.77 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.81 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.3 mm? -61.26 -38.22 85.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.717 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -60.38 -45.64 92.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.724 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -60.94 -35.68 77.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.808 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -69.34 -39.93 77.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.006 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 393' ' ' LEU . 9.0 t -60.62 -39.71 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.842 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -40.31 72.04 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.435 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -76.88 -54.27 6.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.101 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.689 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.5 t80 -24.3 113.11 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.051 -0.977 . . . . 0.0 113.222 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.616 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.5 p -104.71 28.11 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.351 178.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.689 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -50.58 -179.96 0.03 OUTLIER Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.87 -0.605 . . . . 0.0 113.411 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.88 143.51 48.33 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.708 -0.746 . . . . 0.0 111.636 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -20.46 43.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.493 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.2 m -101.87 -14.33 17.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.751 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.5 ' OD2' ' HB3' ' A' ' 408' ' ' ALA . 23.7 t70 -77.47 151.44 34.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.786 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.9 OUTLIER -71.29 -32.02 68.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 179.788 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.5 ' HB3' ' OD2' ' A' ' 406' ' ' ASP . . . -62.89 -29.1 70.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.342 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.529 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 29.8 t80 -64.23 -45.4 88.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.797 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.786 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.3 p-90 -72.82 -27.84 62.2 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 118.826 -1.149 . . . . 0.0 108.677 177.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.568 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.3 mp -67.59 -41.37 84.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.521 177.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 1.019 HD12 HD11 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.35 -47.21 86.91 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.285 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.545 ' HG2' HD23 ' A' ' 449' ' ' LEU . 11.3 mt-10 -70.49 -32.37 69.85 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.483 177.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.83 -43.42 96.25 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.721 -179.676 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.739 ' CE ' HD11 ' A' ' 393' ' ' LEU . 18.7 ttt -69.66 -41.37 75.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.266 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.626 HD13 ' O ' ' A' ' 416' ' ' LEU . 0.4 OUTLIER -66.04 -37.21 85.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.721 179.637 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.435 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 85.0 m -67.71 -30.31 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.91 -38.4 72.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.441 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.71 ' OE2' HG13 ' A' ' 390' ' ' VAL . 5.4 pt-20 -70.78 -37.95 73.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.556 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.854 HD12 ' N ' ' A' ' 421' ' ' LEU . 4.2 pp -72.97 -33.32 65.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 110.851 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.854 ' N ' HD12 ' A' ' 420' ' ' LEU . 1.1 tp -68.49 -32.24 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -71.1 -39.48 72.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.793 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.691 HD13 ' HB1' ' A' ' 441' ' ' ALA . 3.0 mt -58.56 -31.74 68.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.833 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.13 -25.04 17.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.082 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 38.3 t -55.44 -31.02 61.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.023 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 7.6 m -74.68 120.87 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.109 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -88.4 143.15 27.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.411 HG21 ' CG1' ' A' ' 434' ' ' VAL . 27.1 p -131.23 -170.51 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.883 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -147.86 -90.58 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.516 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -96.45 29.76 9.79 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 89.82 4.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -40.05 96.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.809 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.3 t -60.0 -41.03 91.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.827 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.411 ' CG1' HG21 ' A' ' 428' ' ' THR . 32.1 t -71.4 -35.61 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.978 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 435' ' ' ARG . . . . . 0.434 ' HA ' ' HD3' ' A' ' 438' ' ' ARG . 0.1 OUTLIER -64.5 -43.54 93.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.716 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 436' ' ' GLN . . . . . 0.402 ' HA ' ' HG2' ' A' ' 439' ' ' LYS . 2.8 tt0 -69.19 -32.85 72.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.871 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.33 -45.13 61.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.863 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.434 ' HD3' ' HA ' ' A' ' 435' ' ' ARG . 14.5 ptm180 -64.12 -44.55 91.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.572 0.225 . . . . 0.0 111.333 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 439' ' ' LYS . . . . . 0.436 ' HG3' ' N ' ' A' ' 440' ' ' GLU . 1.5 pttt -63.72 -32.87 74.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.903 0.382 . . . . 0.0 110.576 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 440' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 4.7 mm-40 -67.75 -31.24 71.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.533 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.691 ' HB1' HD13 ' A' ' 423' ' ' LEU . . . -70.59 -40.2 73.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.798 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.561 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 21.2 t -62.86 -34.13 64.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 66.0 m -70.7 -43.52 68.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.732 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.87 -44.75 69.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.009 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.776 HD13 HD22 ' A' ' 420' ' ' LEU . 2.3 pp -63.89 -31.13 51.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.107 0.48 . . . . 0.0 110.697 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -39.88 90.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.341 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.56 81.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.055 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.801 ' CG2' HG21 ' A' ' 397' ' ' VAL . 19.3 mt -72.67 -38.33 58.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.545 HD23 ' HG2' ' A' ' 413' ' ' GLU . 3.5 mt -57.76 -48.52 79.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -70.18 -37.17 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.638 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.89 -31.27 66.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.082 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 1.019 HD11 HD12 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -76.23 -36.74 58.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.444 179.351 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.74 -29.91 65.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.602 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.11 -13.46 28.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.248 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.415 ' CE ' HG12 ' A' ' 397' ' ' VAL . 0.0 OUTLIER -82.42 -24.24 34.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.809 0.338 . . . . 0.0 110.6 179.82 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -79.11 -80.61 0.75 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.368 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.255 -0.878 . . . . 0.0 110.862 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 14.9 m -108.01 135.33 19.88 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.515 0.198 . . . . 0.0 110.87 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.66 130.22 12.43 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.508 2.139 . . . . 0.0 112.393 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -112.8 94.22 4.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.763 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -97.46 -41.44 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.084 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.828 HG21 HG13 ' A' ' 384' ' ' ILE . 0.6 OUTLIER -140.67 170.6 9.18 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.057 -179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.483 ' HB2' ' HB ' ' A' ' 380' ' ' ILE . 35.0 Cg_exo -60.6 174.98 1.34 Allowed 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.703 2.268 . . . . 0.0 111.932 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.481 ' HD2' ' HB3' ' A' ' 377' ' ' PRO . 6.2 Cg_endo -48.29 -77.29 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.874 2.383 . . . . 0.0 113.274 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 11.4 m -96.55 -18.14 20.0 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.916 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.4 mm -58.85 -30.09 41.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.229 0.538 . . . . 0.0 109.691 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 20.2 pttt -56.66 -33.01 65.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.932 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.648 ' O ' HG23 ' A' ' 386' ' ' VAL . 32.4 mttt -65.07 -42.96 93.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.589 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.916 HG22 ' O ' ' A' ' 380' ' ' ILE . 0.8 OUTLIER -60.57 -32.04 50.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.828 HG13 HG21 ' A' ' 376' ' ' THR . 0.3 OUTLIER -74.88 -44.76 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.545 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -56.69 -47.31 80.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.692 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 382' ' ' LYS . 37.2 t -65.43 -34.5 70.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.669 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.44 82.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.49 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 388' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 0.6 OUTLIER -62.73 -34.64 77.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.581 178.897 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 389' ' ' LYS . . . . . 0.803 ' O ' HD23 ' A' ' 393' ' ' LEU . 0.0 OUTLIER -70.16 -34.67 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.438 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 386' ' ' VAL . 28.2 t -67.08 -46.76 83.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 13.5 pt20 -60.36 -40.93 92.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -68.52 -38.77 81.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.302 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.84 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.6 mm? -64.91 -37.9 89.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.323 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 394' ' ' GLU . . . . . 0.407 ' HB2' HD11 ' A' ' 448' ' ' ILE . 4.5 tt0 -58.86 -44.0 90.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.457 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.5 -39.64 88.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.694 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -69.24 -40.05 78.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.908 HG21 HG21 ' A' ' 448' ' ' ILE . 23.7 t -60.63 -36.98 74.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.68 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -38.31 70.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.203 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.501 ' O ' ' C ' ' A' ' 400' ' ' PHE . 18.2 tt0 -79.84 -55.46 4.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.043 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.648 ' CE1' HD23 ' A' ' 412' ' ' LEU . 20.4 t80 -4.71 109.12 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.404 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 23.3 m -101.47 25.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.692 178.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.602 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -67.36 -173.59 6.53 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.843 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.0 143.74 48.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.305 -0.447 . . . . 0.0 111.496 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.455 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -57.27 -24.3 53.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.903 179.147 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 405' ' ' THR . . . . . 0.425 HG22 ' O ' ' A' ' 405' ' ' THR . 7.6 m -103.84 13.33 33.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.204 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.71 149.24 28.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.791 0.329 . . . . 0.0 110.687 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.782 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.16 -30.09 70.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.97 0.414 . . . . 0.0 110.9 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.78 -29.15 70.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.012 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 3.0 t80 -68.01 -45.56 73.68 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.782 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.13 63.84 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.691 177.798 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.577 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -66.44 -40.05 89.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.423 177.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -60.83 -47.25 87.21 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.117 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.544 ' HA ' HD21 ' A' ' 416' ' ' LEU . 0.9 OUTLIER -70.73 -32.27 69.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.729 177.811 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.85 -45.26 90.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.636 -179.165 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.502 ' HA ' ' HG2' ' A' ' 418' ' ' LYS . 21.4 ptp -66.45 -44.79 81.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.748 0.309 . . . . 0.0 111.136 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.676 HD12 ' N ' ' A' ' 417' ' ' THR . 4.1 pp -69.26 -37.13 77.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.831 0.348 . . . . 0.0 111.073 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.676 ' N ' HD12 ' A' ' 416' ' ' LEU . 98.5 m -73.61 -44.03 58.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.679 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -58.01 -37.96 75.25 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.599 -179.627 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.498 ' OE2' HG22 ' A' ' 390' ' ' VAL . 19.0 pt-20 -72.27 -34.8 68.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.206 0.527 . . . . 0.0 109.651 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.86 ' HA ' HD12 ' A' ' 423' ' ' LEU . 15.5 tp -65.98 -44.13 85.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.446 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.63 -34.07 75.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.78 -39.46 94.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.433 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.86 HD12 ' HA ' ' A' ' 420' ' ' LEU . 6.7 mt -60.21 -35.17 74.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.789 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.24 -28.85 57.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.061 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.3 m -57.01 -34.87 68.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.962 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.06 120.15 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.0 158.13 8.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.992 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.446 ' HA ' HG21 ' A' ' 434' ' ' VAL . 72.3 p -122.71 -72.69 0.67 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 71.9 -100.47 0.93 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.551 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -118.71 72.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.479 ' HB3' HG22 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -160.21 108.8 1.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.902 0.382 . . . . 0.0 110.823 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.57 -28.63 67.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.397 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.8 m -57.54 -44.97 85.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.685 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.479 HG22 ' HB3' ' A' ' 431' ' ' GLN . 17.2 m -76.11 -35.48 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.147 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -44.43 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.872 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -35.8 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.777 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.96 -32.13 65.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.99 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.537 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -72.72 -42.45 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.354 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 -36.64 84.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.567 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -42.57 99.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.81 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.523 ' CB ' HD13 ' A' ' 423' ' ' LEU . . . -62.07 -45.57 92.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.915 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.573 HG22 HD11 ' A' ' 420' ' ' LEU . 22.2 t -63.96 -31.64 54.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.909 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 97.9 m -70.7 -46.78 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.924 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -44.76 76.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.763 HG12 HD13 ' A' ' 420' ' ' LEU . 2.4 pp -64.14 -31.13 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.792 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -46.58 88.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.152 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -63.08 -36.03 82.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.684 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.908 HG21 HG21 ' A' ' 397' ' ' VAL . 17.6 mt -73.14 -36.54 50.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.806 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.49 -49.26 76.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.702 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -41.87 66.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.416 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.9 mmtp -57.88 -30.01 65.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.083 0.468 . . . . 0.0 110.007 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.462 HD12 HG13 ' A' ' 397' ' ' VAL . 1.8 tp -76.72 -36.72 56.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.438 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -56.98 -29.9 63.65 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -96.52 -11.16 25.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.477 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.56 -24.69 33.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -94.66 -71.34 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.416 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.401 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.935 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 112.524 -0.23 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 22.4 t -63.22 111.07 4.3 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.537 0.208 . . . . 0.0 110.903 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.23 111.35 3.06 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.468 2.112 . . . . 0.0 112.253 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -119.4 131.75 55.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.946 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 60.81 173.86 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.896 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 1.6 p -145.13 151.26 47.92 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.942 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.639 ' HD2' HD12 ' A' ' 380' ' ' ILE . 58.4 Cg_exo -53.19 -175.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.646 2.23 . . . . 0.0 112.409 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.415 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 73.2 Cg_endo -88.63 -9.19 4.92 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.798 2.332 . . . . 0.0 113.555 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.65 -25.96 8.86 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.746 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.654 HG22 HD11 ' A' ' 384' ' ' ILE . 3.2 mt -58.71 -29.77 40.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.371 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -56.8 -33.17 66.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.978 -179.815 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -67.48 -38.03 83.77 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.135 0.493 . . . . 0.0 110.745 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 40.8 mm -60.44 -33.58 54.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.63 178.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.654 HD11 HG22 ' A' ' 380' ' ' ILE . 0.4 OUTLIER -74.74 -44.41 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.411 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.57 -45.12 81.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.062 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 382' ' ' LYS . 57.8 t -66.13 -39.63 84.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.162 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.681 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.58 -32.57 73.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.292 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -35.14 79.18 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -38.06 74.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.184 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.681 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.9 p -70.38 -37.7 71.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.582 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -66.9 -40.97 87.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.841 0.353 . . . . 0.0 110.624 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -40.75 75.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.468 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.898 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.7 OUTLIER -62.04 -38.65 89.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.426 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -59.63 -47.32 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.676 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -36.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.659 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -69.32 -37.5 77.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.096 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 393' ' ' LEU . 25.6 t -60.53 -45.64 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.218 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -55.49 -31.92 62.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.915 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -87.4 -54.39 4.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.52 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.799 ' CE2' HD22 ' A' ' 412' ' ' LEU . 4.1 t80 -48.11 113.54 0.76 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.741 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.468 ' O ' ' O ' ' A' ' 402' ' ' GLY . 28.7 m -47.68 -31.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.881 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.689 ' HA2' ' CZ ' ' A' ' 400' ' ' PHE . . . 37.4 106.7 0.01 OUTLIER Glycine 0 C--O 1.228 -0.264 0 N-CA-C 114.679 0.632 . . . . 0.0 114.679 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.25 143.0 48.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.039 0.447 . . . . 0.0 110.893 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.487 ' HG2' ' CB ' ' A' ' 457' ' ' LEU . 0.2 OUTLIER -60.09 -22.18 62.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.217 179.764 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.99 1.1 51.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.35 135.64 53.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.917 0.389 . . . . 0.0 110.564 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.706 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 10.9 mtmt -61.01 -29.87 69.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.641 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 412' ' ' LEU . . . -62.71 -28.97 70.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.054 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 38.5 t80 -67.23 -45.85 75.55 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.706 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -73.05 -30.27 63.59 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 118.824 -1.15 . . . . 0.0 108.934 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.579 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.0 tp -69.63 -38.45 77.22 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.743 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 1.044 HD23 HD11 ' A' ' 452' ' ' LEU . 0.3 OUTLIER -62.31 -47.16 85.49 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -70.64 -32.81 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.408 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.1 mt-10 -64.1 -43.6 94.85 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.824 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 39.2 ttm -69.59 -35.26 75.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.659 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 11.3 tp -63.41 -48.08 79.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.818 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 52.7 m -65.01 -30.46 71.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.066 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -47.34 85.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.259 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.45 ' OE2' HG23 ' A' ' 390' ' ' VAL . 2.9 pt-20 -67.21 -36.16 81.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.577 HD13 ' C ' ' A' ' 420' ' ' LEU . 3.1 tm? -67.74 -34.64 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.001 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.22 -31.9 69.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -43.0 98.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.772 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 438' ' ' ARG . 0.2 OUTLIER -54.79 -31.15 58.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.014 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -76.64 -14.19 60.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 5.8 m -84.58 -25.79 28.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.768 0.318 . . . . 0.0 111.143 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.6 137.73 24.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.167 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.9 164.55 25.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.541 HG21 HH11 ' A' ' 438' ' ' ARG . 2.0 t -178.48 126.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.71 -84.97 1.78 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.439 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.89 38.09 1.86 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.473 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.559 ' HB3' HG22 ' A' ' 434' ' ' VAL . 0.5 OUTLIER -91.77 123.82 35.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 110.892 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -67.69 -28.65 67.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.076 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.6 t -67.17 -44.85 78.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.675 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.559 HG22 ' HB3' ' A' ' 431' ' ' GLN . 21.4 m -75.47 -37.59 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.733 0.301 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 40.1 mtt180 -67.66 -44.65 77.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.911 0.386 . . . . 0.0 110.697 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -69.41 -34.46 74.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.94 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.24 -45.22 57.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.513 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.541 HH11 HG21 ' A' ' 428' ' ' THR . 0.9 OUTLIER -65.06 -39.12 92.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.781 0.324 . . . . 0.0 110.884 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -35.21 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.529 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.38 -35.89 80.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.441 ' CB ' HD13 ' A' ' 423' ' ' LEU . . . -62.09 -45.43 93.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.548 HG22 HD21 ' A' ' 420' ' ' LEU . 24.3 t -62.96 -33.29 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.752 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.2 m -70.73 -45.23 65.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.506 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -44.65 77.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.062 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.618 HD12 ' N ' ' A' ' 446' ' ' GLN . 2.8 pp -63.37 -31.03 51.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.618 ' N ' HD12 ' A' ' 445' ' ' ILE . 5.6 tp-100 -65.1 -41.54 94.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.508 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.49 -40.2 92.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.401 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.6 mt -67.7 -36.66 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -46.99 83.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.698 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -40.58 68.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.536 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -30.6 66.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.025 0.44 . . . . 0.0 109.967 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 1.044 HD11 HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -77.59 -36.76 51.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.264 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.5 -29.94 69.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.629 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -86.64 -18.8 30.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.427 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 402' ' ' GLY . 0.0 OUTLIER -82.25 -25.93 33.65 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.828 ' O ' HD12 ' A' ' 457' ' ' LEU . . . -130.42 -115.96 1.8 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.828 HD12 ' O ' ' A' ' 456' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.03 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.174 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.41 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 0.3 OUTLIER -178.5 -61.78 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.626 0.251 . . . . 0.0 110.93 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 373' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 56.6 Cg_endo -70.62 149.45 61.39 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.466 2.111 . . . . 0.0 112.289 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -159.54 -51.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.001 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -132.58 96.15 3.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.09 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.2 123.97 67.51 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.737 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.628 ' HG2' HG13 ' A' ' 380' ' ' ILE . 52.7 Cg_exo -56.85 172.53 0.73 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.563 2.175 . . . . 0.0 112.394 -179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -77.85 -54.8 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.056 2.504 . . . . 0.0 113.597 -178.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 66.0 m -85.98 -22.66 27.23 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.686 HG22 HD11 ' A' ' 384' ' ' ILE . 43.8 mm -58.63 -29.77 40.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.474 ' HA ' HG12 ' A' ' 384' ' ' ILE . 27.3 mtmm -56.92 -33.16 66.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.06 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -67.92 -37.97 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.133 0.492 . . . . 0.0 110.694 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.877 HG21 ' HB1' ' A' ' 437' ' ' ALA . 37.5 mt -60.55 -33.6 55.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.41 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.686 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.77 -44.65 45.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.237 178.477 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -49.38 77.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.669 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.724 HG21 ' HB3' ' A' ' 423' ' ' LEU . 14.5 p -65.47 -45.02 94.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.494 ' N ' HG13 ' A' ' 386' ' ' VAL . 5.3 tt -63.38 -33.41 75.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.8 -35.05 78.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.741 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.38 -40.26 93.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.286 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.86 HG22 ' OE2' ' A' ' 419' ' ' GLU . 24.6 t -64.35 -37.01 78.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 -41.15 89.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -63.42 -38.52 91.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.455 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.802 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -63.77 -38.03 89.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 179.544 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.93 -42.79 90.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.639 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.95 -40.3 92.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -69.12 -45.26 70.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.777 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 393' ' ' LEU . 23.1 t -60.65 -36.91 73.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.705 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -58.42 -40.36 82.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.101 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -84.16 -67.55 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.809 ' CD1' HD22 ' A' ' 412' ' ' LEU . 18.6 t80 21.96 107.83 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 401' ' ' VAL . 20.4 t -95.79 25.93 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.065 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.583 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -84.88 -176.8 50.95 Favored Glycine 0 N--CA 1.441 -0.99 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.732 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.25 143.81 48.02 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.404 -0.398 . . . . 0.0 111.628 -179.73 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.492 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -58.6 -23.52 58.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.82 0.343 . . . . 0.0 110.867 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 405' ' ' THR . . . . . 0.414 HG22 ' HD2' ' A' ' 404' ' ' LYS . 16.1 p -101.99 12.96 36.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.104 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.64 153.5 26.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.8 0.334 . . . . 0.0 110.873 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.819 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.2 mttt -61.15 -30.1 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.899 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.73 -29.19 70.49 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.508 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.492 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 3.7 t80 -72.06 -45.67 59.86 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.343 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.819 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -73.07 -29.36 62.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 118.841 -1.144 . . . . 0.0 108.9 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 15.8 tp -69.68 -41.32 75.61 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.428 178.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.809 HD22 ' CD1' ' A' ' 400' ' ' PHE . 8.0 tp -61.07 -46.71 89.56 Favored 'General case' 0 C--N 1.34 0.168 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.454 ' HG2' HD11 ' A' ' 416' ' ' LEU . 1.1 tt0 -70.2 -32.16 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.602 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.5 OUTLIER -63.9 -37.78 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.83 -179.652 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 5.9 ttt -69.75 -44.57 69.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.173 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.847 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -68.88 -37.01 78.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.791 0.329 . . . . 0.0 110.843 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.847 ' N ' HD12 ' A' ' 416' ' ' LEU . 90.4 m -62.58 -33.57 75.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.493 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -66.35 -47.46 73.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.138 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.86 ' OE2' HG22 ' A' ' 390' ' ' VAL . 0.3 OUTLIER -69.77 -34.7 74.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.804 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.82 HD12 ' CG2' ' A' ' 445' ' ' ILE . 6.2 tt -59.6 -44.42 93.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.864 178.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' A' ' 421' ' ' LEU . 1.7 tp -70.51 -31.82 69.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.354 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.67 -46.88 87.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.427 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.777 HD21 HD11 ' A' ' 445' ' ' ILE . 1.7 pp -74.55 -31.06 61.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.797 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.78 -19.46 61.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.116 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 35.5 t -95.3 35.38 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.197 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 426' ' ' VAL . . . . . 0.449 HG13 ' O ' ' A' ' 423' ' ' LEU . 34.1 m -97.78 131.92 43.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -91.85 128.15 37.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.1 t -113.94 145.31 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.92 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.29 66.46 0.55 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.439 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.35 74.49 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.495 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.468 ' OE1' HG21 ' A' ' 434' ' ' VAL . 86.1 mt-30 -97.22 114.03 25.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 0.0 110.844 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.79 -31.58 72.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 18.5 t -63.48 -44.42 94.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.468 HG21 ' OE1' ' A' ' 431' ' ' GLN . 21.8 t -68.47 -38.94 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.116 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -44.61 96.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.884 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -69.23 -35.64 76.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.851 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.877 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.19 -37.02 66.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.181 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.73 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.3 OUTLIER -72.7 -44.69 61.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 -179.809 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -34.09 75.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.879 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.13 -41.76 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -63.75 -45.73 88.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.339 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 438' ' ' ARG . 34.0 t -63.82 -32.81 58.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.873 0.368 . . . . 0.0 110.854 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.88 -43.57 98.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.588 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.21 -37.78 88.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.82 ' CG2' HD12 ' A' ' 420' ' ' LEU . 14.7 mt -63.26 -33.21 59.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.106 0.479 . . . . 0.0 110.575 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.22 -47.72 83.19 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.752 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.58 70.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.862 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.788 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.6 mt -62.52 -37.07 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.643 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -52.93 63.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.647 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -39.53 86.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.525 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.4 ttpp -57.89 -30.12 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.209 0.528 . . . . 0.0 109.729 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' A' ' 400' ' ' PHE . 36.4 tp -72.82 -36.43 67.53 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.416 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.91 -29.9 60.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.221 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.36 -22.8 32.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.198 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.37 -21.89 35.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -69.07 -99.98 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.401 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.923 179.968 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 112.53 -0.228 . . . . 0.0 112.53 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 34.3 m -90.8 115.67 64.75 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.505 0.193 . . . . 0.0 110.911 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -67.33 -177.21 1.03 Allowed 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.408 2.072 . . . . 0.0 112.265 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 63.62 125.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -88.02 142.5 27.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 13.1 p -141.45 77.81 19.23 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.859 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.427 ' HG2' HG13 ' A' ' 380' ' ' ILE . 74.9 Cg_exo -51.46 -177.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.67 2.246 . . . . 0.0 112.626 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.89 -67.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.993 2.462 . . . . 0.0 113.097 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 24.0 m -63.9 -24.18 67.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.735 ' HA ' HD12 ' A' ' 383' ' ' ILE . 31.3 mm -58.71 -29.87 40.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.461 ' HA ' HG12 ' A' ' 384' ' ' ILE . 15.2 mtmt -56.96 -33.26 66.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.82 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.455 ' O ' HG12 ' A' ' 386' ' ' VAL . 4.1 mttt -67.62 -38.02 83.33 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.128 0.489 . . . . 0.0 110.763 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.738 HG21 ' HB1' ' A' ' 437' ' ' ALA . 24.8 mt -60.48 -34.01 56.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.449 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.643 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.66 -44.78 46.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.204 178.445 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -48.53 81.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.468 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.497 HG13 ' N ' ' A' ' 387' ' ' LEU . 14.5 p -67.45 -45.88 84.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.497 ' N ' HG13 ' A' ' 386' ' ' VAL . 6.5 tt -64.59 -33.62 76.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.378 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -62.68 -35.06 78.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.704 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -39.18 91.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.1 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.867 HG13 ' OE2' ' A' ' 419' ' ' GLU . 40.5 t -66.81 -36.03 76.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.413 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -40.97 85.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.582 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -48.0 76.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.47 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.811 HD22 HD23 ' A' ' 416' ' ' LEU . 4.9 tt -60.88 -38.09 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.406 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -39.32 83.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.379 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -61.48 -40.51 94.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.427 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -68.11 -40.89 82.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.638 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.728 HG23 ' O ' ' A' ' 393' ' ' LEU . 22.0 t -60.67 -30.5 47.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.693 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -61.99 -36.82 82.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.188 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -87.48 -67.75 0.8 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.215 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.951 ' CD1' HD22 ' A' ' 412' ' ' LEU . 5.5 t80 56.13 159.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.423 0.63 . . . . 0.0 111.915 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 m -142.26 20.49 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.056 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.563 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -108.18 -172.68 21.7 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.799 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.442 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.08 144.53 48.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.718 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.554 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.77 -28.6 15.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.124 179.238 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.7 t -102.68 15.89 28.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -115.44 157.69 23.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.92 0.39 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.831 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.8 tmtt? -61.18 -30.09 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.963 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.85 -29.13 70.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.632 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.554 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 11.0 t80 -75.18 -45.9 37.64 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.831 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -73.1 -31.99 64.69 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.68 -1.208 . . . . 0.0 108.61 177.779 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.607 HD11 ' CE ' ' A' ' 415' ' ' MET . 38.7 tp -65.67 -41.11 92.84 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.093 177.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.956 HD23 HD21 ' A' ' 452' ' ' LEU . 30.4 tp -59.66 -46.73 88.14 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.18 -31.72 69.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.773 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.9 tm-20 -63.28 -43.39 98.04 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.983 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.607 ' CE ' HD11 ' A' ' 411' ' ' LEU . 9.7 mmt -67.06 -40.18 87.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 109.664 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.811 HD23 HD22 ' A' ' 393' ' ' LEU . 1.2 tm? -61.11 -37.36 82.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.645 179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 3.6 m -62.84 -42.18 99.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.884 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -47.22 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.844 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.867 ' OE2' HG13 ' A' ' 390' ' ' VAL . 3.9 pt-20 -70.85 -34.78 72.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.372 . . . . 0.0 110.125 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 1.042 HD11 HD13 ' A' ' 445' ' ' ILE . 1.2 tt -61.61 -45.1 95.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.122 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 421' ' ' LEU . 3.4 tp -70.21 -31.88 69.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.785 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -58.9 -46.29 88.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.837 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 419' ' ' GLU . 1.2 mt -59.54 -31.42 69.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.806 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -100.47 29.18 4.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.913 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 57.6 m -107.96 -29.22 9.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 15.0 m -66.54 133.5 31.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.08 166.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.498 ' HB ' HG11 ' A' ' 434' ' ' VAL . 1.8 t -156.67 -45.84 0.07 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.914 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 75.01 -69.28 1.9 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.444 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -164.5 40.71 0.3 Allowed Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.425 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -96.38 119.56 35.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -63.11 -31.45 72.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.859 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.7 m -67.65 -42.38 82.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.939 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.498 HG11 ' HB ' ' A' ' 428' ' ' THR . 26.2 t -73.44 -43.46 55.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 435' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 438' ' ' ARG . 4.7 mtt180 -59.21 -40.64 86.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.752 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -69.4 -34.58 74.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.892 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.738 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -71.77 -45.34 61.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.634 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 435' ' ' ARG . 0.2 OUTLIER -66.33 -35.06 79.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.389 . . . . 0.0 110.602 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -34.25 77.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -67.33 -37.0 82.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.76 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.478 ' HB1' HD13 ' A' ' 423' ' ' LEU . . . -61.95 -45.53 93.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.058 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.543 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 31.5 t -63.32 -32.76 57.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.788 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -46.79 62.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.023 0.44 . . . . 0.0 110.815 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.73 88.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.046 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 1.042 HD13 HD11 ' A' ' 420' ' ' LEU . 1.9 pp -63.37 -31.15 51.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.99 0.424 . . . . 0.0 110.609 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.32 -47.7 84.89 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.837 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.74 -35.85 79.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.466 HD12 ' HA ' ' A' ' 445' ' ' ILE . 41.6 mt -70.16 -36.4 67.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.861 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -48.33 79.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.72 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -39.71 91.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.24 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -57.77 -30.1 65.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.166 0.508 . . . . 0.0 109.692 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.956 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -72.08 -37.28 69.64 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.378 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -58.07 -29.91 65.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.63 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' LYS . . . . . 0.402 ' O ' HD13 ' A' ' 457' ' ' LEU . 7.8 mtmt -91.01 -15.07 30.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.485 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -24.41 34.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.884 0.373 . . . . 0.0 110.583 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.32 -86.58 0.35 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.262 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 454' ' ' LYS . 3.8 mp . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.774 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 112.462 -0.255 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.421 ' N ' ' HD2' ' A' ' 373' ' ' PRO . 2.4 t -178.6 -61.67 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.597 0.237 . . . . 0.0 110.94 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 373' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 372' ' ' SER . 37.2 Cg_endo -65.75 109.81 1.53 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.396 2.064 . . . . 0.0 112.32 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -135.1 50.34 2.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.739 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 61.46 153.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.847 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.29 156.75 63.07 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.952 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.635 ' HG2' ' HB ' ' A' ' 380' ' ' ILE . 95.0 Cg_endo -80.81 167.78 18.17 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.794 2.329 . . . . 0.0 112.295 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -96.77 -9.74 0.79 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.197 2.598 . . . . 0.0 114.135 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.41 -28.33 3.96 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.635 ' HB ' ' HG2' ' A' ' 377' ' ' PRO . 24.8 mm -58.62 -29.38 39.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.458 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.55 -33.31 66.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.008 -179.715 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -68.24 -38.09 81.48 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.224 0.535 . . . . 0.0 110.65 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.748 HD11 HG13 ' A' ' 434' ' ' VAL . 47.7 mt -60.49 -33.97 56.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.531 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.59 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.78 -44.63 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.348 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -56.8 -48.44 77.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.323 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.749 HG21 ' HG ' ' A' ' 423' ' ' LEU . 13.5 p -66.41 -36.3 77.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.652 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.34 -35.93 80.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.43 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.79 -34.95 78.33 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -34.65 72.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.54 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 386' ' ' VAL . 21.4 t -70.4 -46.17 71.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.283 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -58.32 -38.8 77.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.683 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.78 -43.42 98.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.895 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -59.78 -38.55 82.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.47 179.531 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 394' ' ' GLU . . . . . 0.426 ' HG3' HD11 ' A' ' 448' ' ' ILE . 0.2 OUTLIER -59.01 -39.88 83.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.602 179.751 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -45.39 92.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.637 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -69.29 -44.26 72.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.76 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 393' ' ' LEU . 28.0 t -60.61 -31.38 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.507 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -60.38 -36.37 77.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.206 0.527 . . . . 0.0 109.928 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.48 ' O ' ' O ' ' A' ' 400' ' ' PHE . 5.2 tt0 -90.73 -69.03 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.926 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.776 ' CD1' HD22 ' A' ' 412' ' ' LEU . 10.2 t80 36.47 109.0 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.118 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 27.8 m -94.81 25.44 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.107 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.528 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.07 -174.46 43.83 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.707 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.81 143.61 48.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.574 -0.313 . . . . 0.0 111.413 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.531 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -56.69 -23.71 44.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.549 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.68 10.15 36.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.308 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.47 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 0.1 OUTLIER -101.93 150.58 23.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.841 0.353 . . . . 0.0 110.474 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.794 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 pptp? -61.13 -30.2 70.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.85 -29.23 70.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.24 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.531 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.6 t80 -69.69 -45.6 67.91 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.794 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 5.5 p-90 -72.87 -30.53 64.05 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.902 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.608 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 26.0 tp -69.69 -38.43 77.01 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.418 177.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.776 HD22 ' CD1' ' A' ' 400' ' ' PHE . 9.7 tp -61.53 -47.19 86.72 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.662 ' HG3' HD13 ' A' ' 452' ' ' LEU . 2.0 mt-10 -70.5 -32.52 70.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.483 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.608 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mm-40 -65.51 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.001 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.67 -44.49 70.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.025 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.769 HD12 ' N ' ' A' ' 417' ' ' THR . 4.3 pp -68.86 -37.05 78.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.782 0.325 . . . . 0.0 110.734 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.769 ' N ' HD12 ' A' ' 416' ' ' LEU . 59.7 m -64.15 -38.97 92.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.621 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -47.28 86.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.459 ' CD ' HD12 ' A' ' 393' ' ' LEU . 14.8 pt-20 -68.53 -34.75 76.42 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.929 ' HB2' HD13 ' A' ' 445' ' ' ILE . 0.3 OUTLIER -60.79 -40.88 94.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.048 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.405 ' HA ' HD12 ' A' ' 421' ' ' LEU . 3.3 tp -69.4 -31.83 70.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.824 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.54 -38.32 87.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.749 ' HG ' HG21 ' A' ' 386' ' ' VAL . 0.3 OUTLIER -58.82 -31.23 68.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.792 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.83 27.8 5.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.5 t -100.11 -29.75 12.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 4.3 m -93.77 123.79 46.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 154.58 22.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.985 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 88.4 m -111.19 -64.39 1.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 108.89 -121.9 6.37 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.442 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -106.01 36.14 4.59 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.395 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -106.9 100.19 9.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.835 0.35 . . . . 0.0 110.921 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.14 -33.93 76.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 4.1 t -60.99 -44.83 96.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.748 HG13 HD11 ' A' ' 383' ' ' ILE . 28.9 t -70.31 -42.45 78.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.152 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -59.62 -40.69 88.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.827 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.31 -41.78 98.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.05 89.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.978 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.81 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -66.67 -44.51 81.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.759 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -67.95 -39.73 83.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.682 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -71.19 -36.57 71.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.781 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.73 -45.54 82.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.001 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.916 ' HA ' HD12 ' A' ' 445' ' ' ILE . 38.6 t -64.58 -33.05 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.024 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 9.4 m -60.89 -43.98 97.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.17 -36.31 83.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.332 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.929 HD13 ' HB2' ' A' ' 420' ' ' LEU . 30.0 mt -63.93 -31.23 52.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -42.54 83.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.145 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.83 78.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.726 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.544 ' CG2' HG21 ' A' ' 397' ' ' VAL . 45.2 mt -65.07 -36.46 77.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.712 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -54.3 48.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.867 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -42.12 88.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.393 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -29.96 65.37 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.762 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -68.73 -38.24 80.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.289 179.152 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.77 -29.85 65.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.896 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.92 -23.57 25.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.221 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -20.06 37.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.775 0.321 . . . . 0.0 110.734 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -67.85 -86.73 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.026 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.489 HD23 ' HG2' ' A' ' 404' ' ' LYS . 1.1 pp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.894 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.4 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 0.3 OUTLIER -72.76 -60.64 1.88 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.698 0.285 . . . . 0.0 110.932 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 373' ' ' PRO . . . . . 0.4 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 59.8 Cg_endo -72.48 -179.81 4.42 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.554 2.169 . . . . 0.0 112.33 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -143.6 157.02 44.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.934 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -94.87 -173.66 3.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.967 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 0.2 OUTLIER 69.16 136.5 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.925 -179.957 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.466 ' HD2' HG13 ' A' ' 380' ' ' ILE . 44.1 Cg_exo -57.07 -176.48 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.537 2.158 . . . . 0.0 112.344 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.402 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 73.9 Cg_endo -86.99 -30.32 0.33 Allowed 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.807 2.338 . . . . 0.0 113.27 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.1 t -90.5 -25.26 20.36 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 120.588 0.232 . . . . 0.0 111.56 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.626 HG22 HD11 ' A' ' 384' ' ' ILE . 42.5 mm -58.72 -29.66 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 16.9 mttt -56.74 -33.12 66.24 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.599 ' O ' HG23 ' A' ' 386' ' ' VAL . 24.3 mtmt -66.41 -38.04 86.56 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.204 0.526 . . . . 0.0 110.694 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 54.5 mt -60.5 -34.76 59.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.398 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.626 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.96 -44.58 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.224 178.392 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -56.65 -37.39 70.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.398 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 382' ' ' LYS . 68.5 t -73.52 -40.69 55.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.484 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.637 ' O ' HG12 ' A' ' 390' ' ' VAL . 1.2 tt -67.57 -37.54 82.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.327 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.94 -34.93 78.51 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -44.48 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.083 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.5 p -63.18 -41.19 91.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.426 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.4 ' HG3' ' N ' ' A' ' 392' ' ' TYR . 11.9 pt20 -63.28 -37.95 89.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.991 0.424 . . . . 0.0 110.433 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.4 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 1.8 m-85 -72.47 -39.83 67.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.427 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.797 HD11 ' HG2' ' A' ' 415' ' ' MET . 0.3 OUTLIER -62.11 -42.48 99.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.89 92.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.713 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -62.21 -35.37 78.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.662 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.28 -42.43 75.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.826 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.784 HG23 ' O ' ' A' ' 393' ' ' LEU . 14.5 t -60.66 -32.45 51.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.666 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -61.2 -36.16 79.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.96 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.503 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.9 tt0 -91.78 -68.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.993 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.858 ' CE1' HD13 ' A' ' 412' ' ' LEU . 6.6 t80 45.02 -84.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.714 -0.675 . . . . 0.0 112.611 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 399' ' ' GLU . 5.7 t 78.35 28.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.508 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -98.57 -150.76 26.35 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.501 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.624 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.44 171.09 14.54 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 120.439 0.162 . . . . 0.0 110.598 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.46 ' HD2' HG23 ' A' ' 405' ' ' THR . 0.0 OUTLIER -91.0 -10.17 43.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.58 0.228 . . . . 0.0 111.155 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 405' ' ' THR . . . . . 0.46 HG23 ' HD2' ' A' ' 404' ' ' LYS . 30.8 p -115.73 -15.55 11.32 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.498 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 18.2 t70 -61.54 162.37 8.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.887 0.375 . . . . 0.0 111.341 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.736 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.36 -38.42 71.57 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.627 179.671 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.418 ' HA ' ' HB2' ' A' ' 411' ' ' LEU . . . -62.69 -29.02 70.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.655 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.624 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 60.4 t80 -57.5 -45.4 84.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.926 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.736 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.58 -29.44 63.53 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 118.865 -1.134 . . . . 0.0 108.663 178.15 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -65.16 -39.34 92.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.356 177.835 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.858 HD13 ' CE1' ' A' ' 400' ' ' PHE . 8.3 tp -61.42 -47.04 87.58 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 30.6 tt0 -70.49 -32.27 69.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.688 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.563 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -64.02 -39.8 94.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.137 -179.426 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.797 ' HG2' HD11 ' A' ' 393' ' ' LEU . 41.2 ttm -69.74 -44.68 69.77 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.292 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 417' ' ' THR . 4.0 pp -68.75 -38.54 80.18 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.766 0.317 . . . . 0.0 110.683 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.78 ' N ' HD12 ' A' ' 416' ' ' LEU . 84.8 m -64.32 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.194 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.631 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -66.01 -42.36 89.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.294 179.509 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.59 -36.65 68.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.318 0.58 . . . . 0.0 110.038 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.839 ' HG ' HG13 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -67.77 -49.26 63.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.833 -179.361 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.982 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -69.74 -31.53 69.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.138 -0.225 . . . . 0.0 111.355 -178.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 422' ' ' GLU . . . . . 0.982 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -61.09 -46.55 90.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.842 0.353 . . . . 0.0 110.791 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.805 HD22 ' HA ' ' A' ' 438' ' ' ARG . 4.2 mt -69.8 -31.0 68.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.061 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -82.41 0.5 41.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.414 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.11 -42.64 8.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 110.945 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.4 t -66.97 136.21 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.216 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -112.6 -178.45 3.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -138.68 160.92 38.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.854 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -126.96 43.34 1.35 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.481 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 136.77 -28.45 2.85 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.495 ' HB3' HG23 ' A' ' 434' ' ' VAL . 72.8 mt-30 -76.95 96.36 4.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.881 0.372 . . . . 0.0 110.905 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.21 -30.06 69.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.982 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -42.93 89.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.962 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.495 HG23 ' HB3' ' A' ' 431' ' ' GLN . 31.2 t -62.78 -35.63 71.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -65.54 -43.81 88.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.12 -32.88 72.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.144 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -68.61 -45.17 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.417 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.806 ' O ' HG23 ' A' ' 442' ' ' VAL . 11.1 ptt85 -72.63 -44.53 61.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.127 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -63.01 -34.61 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.836 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.12 -39.71 65.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.79 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.787 ' HB3' HD13 ' A' ' 423' ' ' LEU . . . -71.01 -45.57 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.1 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.839 HG13 ' HG ' ' A' ' 420' ' ' LEU . 46.9 t -62.86 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.959 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 11.8 t -60.9 -35.55 76.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.68 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.55 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.823 HD12 ' CA ' ' A' ' 420' ' ' LEU . 1.1 mt -65.52 -31.24 52.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -43.95 97.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.127 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.41 86.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.608 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.745 ' CG2' HG21 ' A' ' 397' ' ' VAL . 43.9 mt -67.43 -36.39 76.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.842 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.3 tt -57.35 -47.48 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.888 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -41.35 98.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.804 0.335 . . . . 0.0 110.125 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -30.13 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.778 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -67.15 -38.42 85.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.378 179.044 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.37 -29.89 62.01 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -89.7 -20.08 24.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.402 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -20.29 36.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.006 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.43 -81.55 0.45 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.469 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.955 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.186 0 N-CA-C 112.541 -0.224 . . . . 0.0 112.541 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.407 ' N ' ' HD2' ' A' ' 373' ' ' PRO . 1.0 OUTLIER -63.74 -60.52 8.9 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.702 0.287 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 373' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 372' ' ' SER . 58.0 Cg_endo -71.4 -167.93 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.43 2.087 . . . . 0.0 112.325 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -143.37 -42.53 0.29 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.148 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 66.65 85.59 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.981 0.419 . . . . 0.0 110.78 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.623 HG21 ' HE3' ' A' ' 381' ' ' LYS . 0.2 OUTLIER 71.58 137.89 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.127 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.776 ' CG ' ' HB ' ' A' ' 380' ' ' ILE . 72.8 Cg_endo -71.94 -176.15 1.97 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.042 2.495 . . . . 0.0 112.571 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.474 ' CD ' ' HB2' ' A' ' 377' ' ' PRO . 41.0 Cg_endo -91.97 -74.75 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.003 2.469 . . . . 0.0 113.161 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 44.9 t -80.34 -24.16 40.07 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.776 ' HB ' ' CG ' ' A' ' 377' ' ' PRO . 1.6 mp -58.74 -28.82 38.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.623 ' HE3' HG21 ' A' ' 376' ' ' THR . 0.4 OUTLIER -55.78 -33.11 64.06 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.973 -179.055 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.646 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -66.98 -37.99 85.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.211 0.529 . . . . 0.0 110.617 179.586 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.922 HG21 ' HB1' ' A' ' 437' ' ' ALA . 39.4 mm -60.54 -34.42 58.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.577 178.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.748 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.78 -44.39 45.84 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.608 178.62 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -56.42 -42.55 78.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.836 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.684 ' O ' HG23 ' A' ' 390' ' ' VAL . 38.4 t -70.85 -36.65 65.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.914 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.402 HD21 ' NZ ' ' A' ' 444' ' ' LYS . 0.2 OUTLIER -67.66 -36.05 80.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.157 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -35.1 78.69 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -34.61 73.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.81 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.703 HG22 ' HB3' ' A' ' 419' ' ' GLU . 25.7 t -74.85 -35.82 37.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.312 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -58.37 -41.01 83.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.581 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.28 -41.81 76.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.05 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.761 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -65.39 -37.94 88.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.328 179.384 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -60.9 -41.15 95.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -39.79 88.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.37 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -68.76 -39.17 80.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.524 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 393' ' ' LEU . 35.2 t -60.71 -34.46 58.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.605 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -59.02 -40.24 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.989 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.8 tt0 -86.7 -68.23 0.76 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.823 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.868 ' CE1' HD13 ' A' ' 412' ' ' LEU . 4.7 t80 52.42 -80.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.454 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 401' ' ' VAL . 17.3 t 74.32 29.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.32 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -101.86 -151.38 24.17 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.654 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.64 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.4 OUTLIER -133.46 171.13 14.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.559 0.219 . . . . 0.0 110.732 -179.853 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.487 ' HA ' ' CD1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -91.98 -8.89 44.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.072 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.81 -14.58 11.34 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.484 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 33.8 t70 -63.62 163.05 11.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.913 0.387 . . . . 0.0 111.405 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.743 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.2 OUTLIER -71.52 -38.09 71.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.349 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.69 -28.94 70.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.622 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.64 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 58.4 t80 -58.26 -45.51 87.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.051 -179.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.743 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.64 -30.75 64.57 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 118.92 -1.112 . . . . 0.0 108.658 178.165 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 8.6 tp -64.73 -39.54 93.81 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.135 177.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.868 HD13 ' CE1' ' A' ' 400' ' ' PHE . 7.0 tp -60.48 -46.96 88.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -70.35 -32.2 69.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.9 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.6 -43.25 97.46 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.955 -179.249 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -69.44 -34.9 75.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.279 0.561 . . . . 0.0 110.1 179.143 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.761 HD11 ' HB ' ' A' ' 445' ' ' ILE . 1.8 tm? -60.42 -40.81 92.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.04 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.738 HG22 HD13 ' A' ' 421' ' ' LEU . 1.8 m -71.71 -32.46 67.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.006 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -47.11 84.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.539 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.703 ' HB3' HG22 ' A' ' 390' ' ' VAL . 8.8 mm-40 -63.58 -43.03 98.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.121 0.486 . . . . 0.0 109.703 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.637 HD11 HG22 ' A' ' 442' ' ' VAL . 2.8 tp -62.06 -43.59 98.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.14 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.738 HD13 HG22 ' A' ' 417' ' ' THR . 4.9 mp -61.78 -31.85 72.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.95 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -71.06 -37.14 72.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.741 HD22 ' CB ' ' A' ' 441' ' ' ALA . 0.5 OUTLIER -67.79 -31.02 70.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.925 179.915 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.16 -8.17 55.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.54 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.8 t -53.44 -30.13 38.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.802 0.334 . . . . 0.0 111.169 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 426' ' ' VAL . . . . . 0.579 HG11 HD11 ' A' ' 383' ' ' ILE . 12.1 m -70.79 131.18 34.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -85.58 -30.27 23.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.959 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.706 HG23 ' HB ' ' A' ' 434' ' ' VAL . 16.6 m 61.69 157.62 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.831 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -143.73 60.6 0.52 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.575 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 70.39 28.99 70.47 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.462 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -106.43 117.7 34.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.869 0.366 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.33 -31.44 70.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.85 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.0 t -60.31 -44.8 95.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.842 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.706 ' HB ' HG23 ' A' ' 428' ' ' THR . 26.5 t -75.44 -40.88 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -61.66 -40.99 96.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -34.82 75.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.922 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -67.25 -45.03 77.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.202 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 442' ' ' VAL . 7.2 ptm180 -71.15 -41.12 70.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.933 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 13.4 ttpt -62.2 -31.53 72.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.762 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -72.24 -37.6 69.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.731 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.741 ' CB ' HD22 ' A' ' 423' ' ' LEU . . . -66.64 -45.58 78.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.096 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.637 HG22 HD11 ' A' ' 420' ' ' LEU . 20.1 t -71.73 -30.74 39.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 46.8 t -70.71 -46.72 62.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.977 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 444' ' ' LYS . . . . . 0.402 ' NZ ' HD21 ' A' ' 387' ' ' LEU . 0.3 OUTLIER -68.11 -44.72 75.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.028 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.761 ' HB ' HD11 ' A' ' 416' ' ' LEU . 2.7 pp -63.35 -31.12 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.462 . . . . 0.0 110.771 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.465 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -63.41 -45.76 89.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.271 179.64 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.89 -34.19 74.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.536 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 445' ' ' ILE . 17.1 mt -74.75 -36.48 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.723 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 449' ' ' LEU . 0.2 OUTLIER -57.51 -53.87 53.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.861 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -61.46 -44.08 97.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.823 0.344 . . . . 0.0 110.342 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -29.75 65.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.753 HD21 HD23 ' A' ' 412' ' ' LEU . 0.5 OUTLIER -71.88 -40.04 69.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.803 179.479 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 453' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 454' ' ' LYS . 0.0 OUTLIER -64.28 -29.84 70.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.786 0.327 . . . . 0.0 110.841 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 454' ' ' LYS . . . . . 0.438 ' N ' ' HG3' ' A' ' 453' ' ' GLU . 0.3 OUTLIER -91.6 -13.96 31.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.301 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -82.51 -25.7 33.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.976 0.417 . . . . 0.0 110.465 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -72.66 -64.05 2.7 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.263 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.163 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.421 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 1.0 OUTLIER -178.72 -61.4 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.68 0.276 . . . . 0.0 110.876 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 373' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 60.3 Cg_endo -72.59 -28.83 13.87 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.484 2.123 . . . . 0.0 112.297 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -102.28 31.19 4.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -109.94 75.03 0.92 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.87 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.407 HG22 ' CB ' ' A' ' 381' ' ' LYS . 0.1 OUTLIER -148.33 135.88 10.82 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.13 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.662 ' CG ' ' HB ' ' A' ' 380' ' ' ILE . 59.0 Cg_endo -70.17 175.25 8.69 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.783 2.322 . . . . 0.0 112.212 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 377' ' ' PRO . 10.9 Cg_endo -54.85 -77.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.602 2.201 . . . . 0.0 113.495 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 379' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 382' ' ' LYS . 0.2 OUTLIER -102.37 -23.02 14.0 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -178.628 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.781 ' HA ' HD12 ' A' ' 383' ' ' ILE . 1.1 mm -58.74 -29.55 40.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.474 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.57 -33.22 65.95 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.631 -179.344 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.522 ' HG3' ' N ' ' A' ' 383' ' ' ILE . 0.1 OUTLIER -68.35 -37.63 80.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.077 0.465 . . . . 0.0 110.732 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 380' ' ' ILE . 16.2 mt -60.97 -34.06 58.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.482 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.474 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.97 -44.64 44.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.225 178.526 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -56.49 -47.57 78.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.334 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.582 ' O ' HG23 ' A' ' 390' ' ' VAL . 11.2 p -66.46 -37.38 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.189 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.57 -34.24 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.142 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 388' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 12.1 mt-10 -62.74 -34.83 78.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.57 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -70.27 -34.7 73.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.451 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' ' 386' ' ' VAL . 21.5 t -69.87 -46.35 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.353 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 394' ' ' GLU . 14.5 pt20 -58.46 -37.49 75.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.696 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.408 ' O ' ' CG ' ' A' ' 395' ' ' GLN . 19.1 t80 -72.34 -35.1 68.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.205 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.674 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -70.35 -37.84 74.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.728 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 394' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 391' ' ' GLN . 0.0 OUTLIER -64.87 -38.88 92.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 395' ' ' GLN . . . . . 0.42 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 12.0 pt20 -69.77 -31.65 69.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.849 0.357 . . . . 0.0 110.467 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -68.73 -39.37 80.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.653 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.731 HG13 ' CD2' ' A' ' 412' ' ' LEU . 42.6 t -60.74 -47.29 93.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.593 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -56.69 -38.69 72.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.462 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -74.28 -58.09 3.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.38 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.838 ' CE1' HD22 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -56.86 125.15 21.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.367 0.603 . . . . 0.0 110.456 179.729 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.571 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.7 p -116.53 43.9 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.512 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.576 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.8 -164.3 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.841 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.452 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.83 143.79 48.57 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.789 0.328 . . . . 0.0 111.632 -179.525 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.494 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 7.9 mttt -61.53 -21.13 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.941 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 405' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 405' ' ' THR . 23.7 m -94.22 8.67 40.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.85 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.452 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t70 -115.07 161.78 17.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.976 0.417 . . . . 0.0 111.027 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.736 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.59 -30.0 65.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.3 179.438 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.62 ' HB1' ' HE2' ' A' ' 400' ' ' PHE . . . -62.81 -29.41 70.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.1 -179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.494 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 6.1 t80 -73.72 -46.13 47.89 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.296 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.736 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.3 p-90 -73.08 -29.01 62.64 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 118.853 -1.139 . . . . 0.0 108.78 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.613 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.6 tp -67.35 -39.81 85.77 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.886 177.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.838 HD22 ' CE1' ' A' ' 400' ' ' PHE . 2.6 tp -59.67 -46.91 87.63 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 1.6 tt0 -69.85 -31.68 69.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.421 177.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.613 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 2.4 mm-40 -63.48 -38.67 92.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.271 -179.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 1.9 mmt -69.72 -44.64 69.89 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.749 0.309 . . . . 0.0 111.004 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.875 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.0 -37.17 78.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.578 -179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.875 ' N ' HD12 ' A' ' 416' ' ' LEU . 1.0 OUTLIER -68.38 -43.75 76.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.733 0.302 . . . . 0.0 111.152 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -57.98 -47.22 83.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.382 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.451 ' OE2' HD13 ' A' ' 393' ' ' LEU . 13.6 pt-20 -65.9 -34.94 79.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.598 ' HB2' HG21 ' A' ' 445' ' ' ILE . 0.2 OUTLIER -67.05 -39.05 86.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.1 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.32 -31.8 69.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.918 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.01 -44.42 76.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.921 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.01 -35.86 77.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.878 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -79.35 -20.89 46.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 16.7 t -54.02 -30.91 49.53 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.89 0.376 . . . . 0.0 111.036 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.7 t -79.65 116.08 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.961 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.23 -34.01 61.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.447 HG22 ' HB2' ' A' ' 431' ' ' GLN . 0.2 OUTLIER 66.32 131.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.127 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.98 -89.2 1.79 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.372 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -107.86 64.63 0.26 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.335 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.497 ' HB3' HG23 ' A' ' 434' ' ' VAL . 49.4 mm-40 -139.56 87.5 2.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.851 0.358 . . . . 0.0 110.899 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -40.95 95.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.975 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 2.9 t -59.11 -43.28 91.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.011 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 431' ' ' GLN . 34.3 t -69.11 -35.53 68.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -44.47 78.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -69.31 -33.0 72.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.998 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.51 -44.73 67.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.433 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.897 ' O ' HG23 ' A' ' 442' ' ' VAL . 6.4 ptm180 -69.52 -40.66 76.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.214 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -44.9 82.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.891 0.377 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -69.82 -39.44 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.524 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.136 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 438' ' ' ARG . 41.0 t -62.94 -45.6 98.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.072 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 443' ' ' CYS . . . . . 0.599 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.6 m -60.38 -30.35 69.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.725 0.297 . . . . 0.0 110.213 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 444' ' ' LYS . . . . . 0.42 ' O ' HG13 ' A' ' 448' ' ' ILE . 37.9 tttp -63.94 -43.14 96.73 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.893 ' HA ' HD12 ' A' ' 448' ' ' ILE . 0.9 OUTLIER -73.62 -34.85 42.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.935 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.599 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.3 OUTLIER -60.7 -48.02 83.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.709 178.871 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -55.85 -42.7 76.21 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.72 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 445' ' ' ILE . 11.3 mt -64.52 -36.33 77.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.837 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.13 -44.66 83.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.894 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 -44.07 64.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 0.0 110.193 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 31.1 mtmm -57.86 -29.94 65.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.17 0.509 . . . . 0.0 109.666 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.759 HD11 HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -73.73 -36.71 65.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.441 179.304 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -29.98 67.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -93.68 -19.34 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm -82.55 -20.81 35.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.735 0.303 . . . . 0.0 110.919 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.42 ' HA3' ' CD2' ' A' ' 409' ' ' TYR . . . -82.12 -101.37 0.43 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.43 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.278 -0.868 . . . . 0.0 110.945 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.112 0 N-CA-C 112.524 -0.23 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 19.5 m -115.52 86.06 14.59 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.713 0.292 . . . . 0.0 110.872 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.14 -170.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.588 2.192 . . . . 0.0 112.319 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -64.2 -18.13 64.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.263 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 62.7 122.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.84 0.352 . . . . 0.0 111.013 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.02 129.13 9.59 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.863 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.482 ' HD2' HG13 ' A' ' 380' ' ' ILE . 59.5 Cg_exo -52.57 -179.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.584 2.189 . . . . 0.0 112.322 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -80.1 -37.06 0.46 Allowed 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 123.122 2.548 . . . . 0.0 113.105 -179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.03 -23.37 23.8 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.73 HG22 HD11 ' A' ' 384' ' ' ILE . 31.2 mm -58.65 -29.75 40.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.486 ' HA ' HG12 ' A' ' 384' ' ' ILE . 11.5 mttt -56.77 -33.17 66.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.047 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.603 ' O ' HG23 ' A' ' 386' ' ' VAL . 4.2 pttm -68.27 -38.0 81.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.164 0.507 . . . . 0.0 110.517 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.571 HG21 ' HB1' ' A' ' 437' ' ' ALA . 43.6 mm -60.5 -33.37 54.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.521 178.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.73 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.84 -44.73 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.209 178.495 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -57.0 -49.38 75.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.48 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 382' ' ' LYS . 40.9 t -64.15 -36.13 75.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.41 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.596 ' O ' HD23 ' A' ' 387' ' ' LEU . 6.0 tt -67.46 -34.54 77.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.375 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 388' ' ' GLU . . . . . 0.442 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.0 tt0 -62.77 -35.0 78.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.622 179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -70.41 -34.57 72.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.728 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.679 HG22 ' OE2' ' A' ' 419' ' ' GLU . 25.8 t -65.35 -46.91 89.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 4.6 pt20 -63.15 -37.76 88.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.84 0.352 . . . . 0.0 110.708 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.22 -36.87 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.09 179.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.924 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.5 mt -65.91 -37.77 86.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.296 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 394' ' ' GLU . . . . . 0.409 ' HG3' ' CD1' ' A' ' 448' ' ' ILE . 2.6 mt-10 -58.7 -44.53 90.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.561 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -41.35 89.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.461 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -69.2 -39.92 78.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.013 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 393' ' ' LEU . 25.2 t -60.62 -30.66 47.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.803 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -66.83 -33.13 74.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.415 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' A' ' 400' ' ' PHE . 16.5 tt0 -89.43 -55.41 3.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.533 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.962 ' CD2' HD22 ' A' ' 412' ' ' LEU . 13.8 t80 -20.35 120.27 0.03 OUTLIER 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 401' ' ' VAL . 11.6 p -100.5 29.43 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.625 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.563 ' HA3' ' CE2' ' A' ' 400' ' ' PHE . . . -41.9 162.8 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.527 -0.761 . . . . 0.0 113.777 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.543 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 1.4 mppt? -133.56 143.67 48.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.151 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -17.46 53.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.703 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.4 m -108.4 -15.54 14.43 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.547 ' OD1' ' HB3' ' A' ' 408' ' ' ALA . 14.2 t70 -76.24 135.25 39.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.925 0.393 . . . . 0.0 110.743 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.741 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 mptp? -61.13 -30.82 70.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.214 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.547 ' HB3' ' OD1' ' A' ' 406' ' ' ASP . . . -65.41 -29.13 69.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.409 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 0.2 OUTLIER -68.95 -45.59 70.34 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.539 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.741 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 15.7 p-90 -72.86 -30.13 63.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.069 -1.053 . . . . 0.0 108.886 178.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 25.9 tp -69.76 -38.56 76.81 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.327 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.973 HD23 HD11 ' A' ' 452' ' ' LEU . 0.4 OUTLIER -62.09 -47.26 85.42 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.147 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.823 ' HA ' HD12 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.58 -32.28 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.302 177.826 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.77 -36.42 83.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.532 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.617 ' CE ' HD21 ' A' ' 393' ' ' LEU . 10.9 ttt -69.57 -41.05 76.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.004 0.431 . . . . 0.0 110.171 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.823 HD12 ' HA ' ' A' ' 413' ' ' GLU . 3.9 mt -62.43 -46.92 86.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.639 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.531 HG22 HD13 ' A' ' 421' ' ' LEU . 7.6 m -65.8 -30.44 71.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.767 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -47.31 86.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.159 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.679 ' OE2' HG22 ' A' ' 390' ' ' VAL . 8.5 pt-20 -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.584 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.78 HD21 HG22 ' A' ' 442' ' ' VAL . 3.4 tm? -68.49 -38.85 81.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.472 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.531 HD13 HG22 ' A' ' 417' ' ' THR . 1.3 mp -66.56 -31.98 73.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.668 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -45.07 86.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.748 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.533 HD11 HG11 ' A' ' 386' ' ' VAL . 5.5 mt -57.69 -32.57 67.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -79.88 -31.84 40.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 10.0 t -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 426' ' ' VAL . . . . . 0.44 HG11 ' HE3' ' A' ' 382' ' ' LYS . 21.5 t -80.56 119.64 30.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.078 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -70.39 131.66 44.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.933 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.402 ' CG2' HG11 ' A' ' 434' ' ' VAL . 19.0 p -108.48 -36.91 6.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.888 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 90.39 -91.96 1.73 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.488 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -152.54 47.78 0.55 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.5 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.443 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.1 OUTLIER -93.01 115.64 28.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 0.0 110.797 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -42.97 80.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 25.6 t -64.2 -44.86 90.66 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.923 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.443 HG23 ' HB3' ' A' ' 431' ' ' GLN . 37.8 t -69.55 -40.76 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -44.35 91.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.926 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -38.35 78.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.571 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -66.64 -45.13 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.273 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.707 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.2 ptm180 -68.11 -39.37 82.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.956 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -66.25 -34.44 78.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -71.39 -39.34 71.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.88 97.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.158 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.78 HG22 HD21 ' A' ' 420' ' ' LEU . 31.5 t -62.85 -39.64 85.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.996 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -36.63 79.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.492 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -34.69 78.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.572 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 442' ' ' VAL . 3.1 mm -66.78 -31.19 52.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.14 0.495 . . . . 0.0 110.751 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -45.99 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.663 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.47 -38.46 87.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.039 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.771 ' CG2' HG21 ' A' ' 397' ' ' VAL . 16.3 mt -74.83 -36.57 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.51 -43.56 84.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.938 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.77 62.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.629 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -57.84 -32.67 67.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 109.808 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.973 HD11 HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -77.64 -36.6 51.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.402 179.145 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.17 -30.0 61.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.553 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -91.95 -12.4 33.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.176 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -82.16 -26.4 33.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.125 0.488 . . . . 0.0 110.828 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -82.97 -96.32 0.55 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.375 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.008 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 112.555 -0.218 . . . . 0.0 112.555 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 1.7 m -155.3 58.01 1.79 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.333 . . . . 0.0 110.889 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.54 -169.83 0.34 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.56 2.173 . . . . 0.0 112.285 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 60.5 100.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.948 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -164.78 147.8 8.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.946 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 5.1 p -63.97 109.61 2.88 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.845 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.474 ' HD2' HG13 ' A' ' 380' ' ' ILE . 17.8 Cg_exo -67.29 153.52 76.85 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.671 2.247 . . . . 0.0 111.964 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.46 -14.66 30.9 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.458 2.105 . . . . 0.0 113.146 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 81.3 p -96.68 -26.1 15.31 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.694 0.283 . . . . 0.0 111.461 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.629 HG22 HD11 ' A' ' 384' ' ' ILE . 28.9 mm -58.6 -29.65 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -33.2 66.35 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.849 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -67.25 -38.02 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.091 0.472 . . . . 0.0 110.836 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 380' ' ' ILE . 34.3 mt -60.52 -34.54 58.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.376 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.629 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.94 -44.67 44.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.318 178.444 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.02 -49.35 76.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.411 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.52 -37.78 80.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.483 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.627 ' O ' HG12 ' A' ' 390' ' ' VAL . 4.3 tt -67.57 -32.96 74.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.82 -35.21 79.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.48 66.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.147 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.4 p -63.5 -39.09 84.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.479 -179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.16 -34.52 77.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.901 0.381 . . . . 0.0 110.627 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.99 -43.46 95.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.579 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.65 HD13 ' OE1' ' A' ' 419' ' ' GLU . 0.2 OUTLIER -60.55 -37.91 82.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.596 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -58.79 -44.05 90.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.485 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.62 -31.65 72.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.509 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -68.42 -44.17 75.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.837 HG22 HD11 ' A' ' 412' ' ' LEU . 19.7 t -60.68 -38.05 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.821 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -59.49 -32.58 70.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.522 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 401' ' ' VAL . 9.6 tt0 -78.63 -57.35 3.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.555 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.662 ' CG ' HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -60.34 127.7 33.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.288 0.566 . . . . 0.0 110.53 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.575 ' O ' HG12 ' A' ' 401' ' ' VAL . 22.1 t -123.11 39.86 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.401 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.545 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -53.76 -166.13 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.678 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.518 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.96 149.19 51.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 0.0 111.853 -179.603 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.493 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 2.0 mmmt -58.78 -25.09 62.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.081 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 70.9 p -85.94 3.7 40.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.448 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.518 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 26.4 t70 -111.96 156.68 21.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.111 0.482 . . . . 0.0 111.432 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.759 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.4 mttp -69.31 -29.97 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.039 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.516 ' HB1' ' HE2' ' A' ' 400' ' ' PHE . . . -62.87 -29.42 70.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.328 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.493 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 33.1 t80 -69.2 -45.53 69.65 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.969 -179.055 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.759 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.3 OUTLIER -72.63 -32.66 66.07 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 118.628 -1.229 . . . . 0.0 108.539 178.162 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.588 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 17.8 tp -63.57 -38.35 90.79 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.837 HD11 HG22 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -59.71 -47.15 86.8 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.465 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.493 ' HG2' HD13 ' A' ' 452' ' ' LEU . 4.8 mm-40 -70.38 -31.78 69.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.893 177.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.588 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.32 -40.17 96.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.222 -178.581 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.62 -44.2 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.222 0.534 . . . . 0.0 109.909 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.836 HD11 HG23 ' A' ' 445' ' ' ILE . 7.0 tp -66.36 -41.0 90.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.78 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.43 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 94.9 m -62.69 -30.36 71.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -71.01 -44.65 65.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.596 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.799 ' O ' HD12 ' A' ' 423' ' ' LEU . 15.8 pt-20 -64.23 -44.64 91.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.625 0.25 . . . . 0.0 111.41 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.961 ' HB2' HD13 ' A' ' 445' ' ' ILE . 1.4 pp -66.27 -35.34 80.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.893 0.378 . . . . 0.0 110.511 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.59 HD12 ' CD1' ' A' ' 420' ' ' LEU . 3.9 mp -70.31 -31.87 69.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.446 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.53 -46.28 90.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 419' ' ' GLU . 1.8 mp -66.12 -31.01 71.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.719 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -58.37 -26.5 63.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.01 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.05 38.35 1.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.863 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 14.2 p -91.19 130.02 41.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.64 -70.13 0.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.984 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.509 ' OG1' HG11 ' A' ' 434' ' ' VAL . 27.5 m 67.25 -69.5 0.13 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.028 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 98.37 -60.58 0.92 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 177.76 38.39 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.421 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.528 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.9 OUTLIER -93.43 120.08 33.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.818 0.342 . . . . 0.0 110.926 -179.963 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -31.07 69.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 21.5 t -65.42 -42.03 92.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.932 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.528 HG23 ' HB3' ' A' ' 431' ' ' GLN . 39.9 t -68.29 -37.45 77.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.92 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.755 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.16 -34.37 74.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.924 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.04 -45.16 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.504 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.0 OUTLIER -66.45 -44.24 83.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.972 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -60.46 -39.45 87.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -69.76 -31.71 69.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.727 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.421 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -69.4 -45.66 68.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.11 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 1.005 ' HA ' HD12 ' A' ' 445' ' ' ILE . 25.6 t -64.25 -34.3 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.866 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -45.09 95.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.215 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -37.2 86.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.083 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 1.005 HD12 ' HA ' ' A' ' 442' ' ' VAL . 24.2 mt -64.36 -32.73 58.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.704 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.58 -47.59 83.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.011 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.84 -42.45 93.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.17 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.413 ' CG2' HD22 ' A' ' 416' ' ' LEU . 34.2 mt -63.6 -36.56 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.803 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.417 HD12 ' OE2' ' A' ' 413' ' ' GLU . 2.3 tp -57.58 -47.59 81.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.817 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -34.53 68.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -57.87 -33.2 68.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.987 0.422 . . . . 0.0 110.313 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.83 HD21 HD12 ' A' ' 412' ' ' LEU . 1.8 mt -77.66 -36.79 51.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.434 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.92 -29.87 63.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.791 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -22.2 17.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.059 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -82.43 -19.88 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.958 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -86.32 -103.51 0.76 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.418 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.963 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.419 -0.272 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 7.5 t -151.38 131.39 6.97 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.541 0.21 . . . . 0.0 110.845 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.75 107.86 0.24 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.37 2.047 . . . . 0.0 112.305 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.05 119.33 6.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.87 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.77 -60.6 0.37 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.83 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.43 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 1.4 m -115.11 134.77 22.48 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.805 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.729 ' HD2' HD12 ' A' ' 380' ' ' ILE . 37.3 Cg_exo -60.93 177.79 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.474 2.116 . . . . 0.0 112.131 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -89.88 2.09 5.41 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.815 2.343 . . . . 0.0 113.199 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.03 -23.67 6.28 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.729 HD12 ' HD2' ' A' ' 377' ' ' PRO . 6.0 mt -58.85 -29.91 41.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.564 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.468 ' HA ' HG12 ' A' ' 384' ' ' ILE . 1.3 mttt -56.96 -33.15 66.76 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.868 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.593 ' O ' HG23 ' A' ' 386' ' ' VAL . 2.8 mttm -66.69 -38.04 85.98 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 33.7 mm -60.52 -35.59 64.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.293 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.586 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.91 -44.55 44.9 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.387 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.516 178.383 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -49.25 75.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.782 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.774 HG11 ' HB3' ' A' ' 423' ' ' LEU . 46.5 t -63.77 -33.65 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.672 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.25 -37.84 84.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.558 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 388' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 10.3 mt-10 -62.6 -34.64 77.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.744 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -67.58 -34.66 77.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.477 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.714 HG22 HD11 ' A' ' 445' ' ' ILE . 32.4 t -66.21 -46.69 86.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.2 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 11.7 pt20 -62.89 -40.47 97.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.863 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.415 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 0.2 OUTLIER -68.92 -44.18 73.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.855 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.729 ' O ' HG23 ' A' ' 397' ' ' VAL . 1.1 mm? -58.57 -40.26 82.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.764 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -59.8 -46.61 88.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.018 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.5 -36.14 75.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.14 -41.73 76.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.388 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 393' ' ' LEU . 19.7 t -60.57 -45.75 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.328 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -24.12 31.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.006 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.835 ' O ' HG23 ' A' ' 401' ' ' VAL . 22.6 tt0 -95.77 -55.72 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 1.003 ' CE1' HD22 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -51.85 -27.08 11.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 -179.397 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.835 HG23 ' O ' ' A' ' 399' ' ' GLU . 21.1 t 66.4 -44.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.627 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.559 ' CA ' ' CZ ' ' A' ' 400' ' ' PHE . . . 68.22 158.22 1.18 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.013 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.534 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.3 143.6 49.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.601 179.372 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -67.68 -15.05 63.45 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.6 t -115.54 8.96 15.28 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 35.9 t0 -100.67 136.6 40.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.833 0.349 . . . . 0.0 110.8 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.763 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.31 -31.8 71.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.887 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.97 -29.03 70.5 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.712 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.534 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -65.9 -45.31 82.42 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.763 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.9 p-90 -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.177 178.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.581 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 18.0 tp -69.65 -38.89 77.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.642 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 1.003 HD22 ' CE1' ' A' ' 400' ' ' PHE . 0.3 OUTLIER -62.55 -46.99 85.86 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.141 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.852 ' HG2' HD13 ' A' ' 452' ' ' LEU . 21.5 mt-10 -70.32 -32.42 70.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.429 177.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.581 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 4.5 mt-10 -66.38 -44.6 82.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.9 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 412' ' ' LEU . 8.3 ptm -65.71 -42.43 91.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.679 0.276 . . . . 0.0 111.312 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.658 HD21 ' HA ' ' A' ' 413' ' ' GLU . 3.1 pp -67.24 -36.69 82.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.907 0.384 . . . . 0.0 110.663 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.572 ' N ' HD12 ' A' ' 416' ' ' LEU . 0.7 OUTLIER -62.79 -33.89 76.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.737 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.637 ' HA ' HD12 ' A' ' 421' ' ' LEU . 7.8 mttt -73.06 -34.15 66.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.052 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 416' ' ' LEU . 7.7 pt-20 -72.83 -38.31 67.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.849 HD12 ' N ' ' A' ' 421' ' ' LEU . 4.3 pp -70.5 -43.71 69.13 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.986 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.56 -31.45 68.48 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.163 -179.288 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 422' ' ' GLU . . . . . 0.986 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.1 OUTLIER -64.35 -46.72 82.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.82 0.343 . . . . 0.0 111.47 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.774 ' HB3' HG11 ' A' ' 386' ' ' VAL . 1.9 pp -68.02 -30.94 70.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.167 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 -3.83 41.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.525 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.2 m -86.16 -5.03 59.28 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.553 0.216 . . . . 0.0 111.56 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 426' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 423' ' ' LEU . 26.8 m -66.68 137.82 24.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.864 0.364 . . . . 0.0 111.066 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -73.06 156.49 38.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.887 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 69.1 p -137.24 110.68 7.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.907 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -82.43 -37.0 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.439 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 172.81 49.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.486 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.405 ' HB3' HG23 ' A' ' 434' ' ' VAL . 15.9 mt-30 -126.73 111.33 14.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.772 0.32 . . . . 0.0 110.93 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -67.1 -32.45 73.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.929 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -40.94 96.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 431' ' ' GLN . 25.8 t -71.57 -39.82 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.093 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -44.67 90.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.745 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.53 -43.17 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.161 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.18 91.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.754 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.429 ' O ' HG23 ' A' ' 442' ' ' VAL . 10.1 ptt85 -70.31 -40.42 74.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.68 0.276 . . . . 0.0 111.042 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.84 -32.91 74.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.07 -41.98 63.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.401 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -62.03 -45.57 92.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.21 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.771 HG13 ' HB2' ' A' ' 420' ' ' LEU . 46.2 t -69.55 -38.83 77.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.712 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.36 -39.21 93.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.873 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -63.19 -40.72 98.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.515 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.714 HD11 HG22 ' A' ' 390' ' ' VAL . 0.5 OUTLIER -63.81 -31.18 52.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.798 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -64.2 -41.04 97.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.879 179.327 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.62 -37.27 83.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.237 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 31.7 mt -67.3 -36.4 76.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.58 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 446' ' ' GLN . 1.8 mt -57.29 -46.99 82.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.5 -46.13 89.83 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -58.43 -30.02 66.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.241 0.543 . . . . 0.0 109.614 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.876 HD11 HD23 ' A' ' 412' ' ' LEU . 1.0 OUTLIER -77.29 -36.77 53.89 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.335 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -61.73 -31.8 71.99 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.38 -19.35 20.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.971 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.9 mtmt -82.45 -23.37 34.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.353 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.422 ' HA2' ' O ' ' A' ' 402' ' ' GLY . . . -72.32 -93.13 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.6 mp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.217 179.796 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.419 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 0.0 OUTLIER -178.6 -61.82 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.652 0.263 . . . . 0.0 110.892 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 373' ' ' PRO . . . . . 0.419 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 58.6 Cg_endo -71.51 -27.48 18.84 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.456 2.104 . . . . 0.0 112.376 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -128.45 -177.03 4.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.876 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -95.7 -69.51 0.75 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.059 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 3.2 m 57.63 105.03 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.868 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.532 ' HG2' HG13 ' A' ' 380' ' ' ILE . 72.5 Cg_exo -52.26 -176.2 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.499 2.133 . . . . 0.0 112.638 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 10.1 Cg_exo -72.19 -68.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.036 2.491 . . . . 0.0 113.625 -178.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 63.7 m -70.34 -20.67 62.97 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 -178.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.639 HG22 HD11 ' A' ' 384' ' ' ILE . 34.1 mm -58.68 -30.11 41.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.418 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -59.0 -33.32 70.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.884 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.453 ' O ' HG23 ' A' ' 386' ' ' VAL . 7.5 mtpp -68.19 -38.12 81.66 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.17 0.509 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 37.9 mm -60.45 -34.55 58.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.411 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.639 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.95 -44.72 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.414 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -47.19 80.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.009 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.495 HG12 HD21 ' A' ' 423' ' ' LEU . 47.5 t -70.39 -42.85 78.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.124 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.08 -38.88 92.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.771 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -62.75 -34.71 77.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -40.9 96.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.389 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.57 HG13 ' CD1' ' A' ' 445' ' ' ILE . 56.2 t -61.42 -37.94 78.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.591 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -41.13 93.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.71 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -72.53 -44.54 62.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.642 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.667 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.5 mm? -59.01 -42.48 90.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.755 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.28 -44.33 95.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -35.86 77.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.015 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -45.02 71.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.792 HG21 ' CG2' ' A' ' 448' ' ' ILE . 17.1 t -60.58 -39.6 81.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.975 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -58.52 -38.91 78.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.012 0.434 . . . . 0.0 110.333 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -80.67 -54.45 5.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.349 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.616 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 42.8 t80 -21.4 116.86 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.401 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 25.5 m -111.21 27.03 2.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.192 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.616 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -54.72 -172.82 0.08 OUTLIER Glycine 0 N--CA 1.442 -0.962 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.326 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.515 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.89 143.86 48.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.781 -0.71 . . . . 0.0 111.236 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.406 ' HB2' ' CA ' ' A' ' 457' ' ' LEU . 0.0 OUTLIER -52.25 -27.38 14.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.525 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.32 11.32 29.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.599 -179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -93.17 142.67 27.04 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.784 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.19 -30.29 70.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.983 0.42 . . . . 0.0 110.665 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -68.0 -29.16 68.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.836 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.515 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -66.52 -45.29 79.99 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.784 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 9.3 p-90 -72.67 -30.58 64.39 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 119.045 -1.062 . . . . 0.0 109.13 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.591 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.8 tp -69.79 -38.49 76.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.303 177.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.594 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -63.03 -47.07 84.63 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.092 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.504 ' HA ' HD21 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.33 -32.04 69.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.372 177.86 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.87 -41.46 97.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.49 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 18.5 ptp -69.58 -44.54 70.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.637 0.256 . . . . 0.0 111.448 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.737 HD12 ' N ' ' A' ' 417' ' ' THR . 4.3 pp -66.48 -37.1 84.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.884 0.373 . . . . 0.0 110.231 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.737 ' N ' HD12 ' A' ' 416' ' ' LEU . 99.2 m -62.85 -30.39 71.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.208 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.58 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -72.24 -32.65 66.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.913 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.589 ' O ' HD12 ' A' ' 423' ' ' LEU . 6.8 mm-40 -72.72 -46.38 53.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.307 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 421' ' ' LEU . 2.5 pp -62.96 -46.21 88.79 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.21 -178.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.985 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -68.2 -31.44 70.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 110.817 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 422' ' ' GLU . . . . . 0.985 ' N ' HD13 ' A' ' 421' ' ' LEU . 1.3 tm-20 -58.33 -46.44 86.19 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.842 0.353 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.672 HD22 ' HB3' ' A' ' 441' ' ' ALA . 0.7 OUTLIER -69.08 -33.56 73.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.75 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -68.06 -28.3 67.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.962 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.5 p -96.57 38.53 1.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 426' ' ' VAL . . . . . 0.625 HG11 ' HG3' ' A' ' 438' ' ' ARG . 10.2 p -86.14 137.78 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.85 110.03 16.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.04 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.3 t -156.02 121.7 4.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.16 -49.25 2.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.476 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -136.32 62.96 0.59 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.498 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.596 ' HB3' HG23 ' A' ' 434' ' ' VAL . 41.1 mt-30 -139.27 84.94 2.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.823 0.344 . . . . 0.0 110.922 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.56 -31.89 69.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -42.32 99.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.596 HG23 ' HB3' ' A' ' 431' ' ' GLN . 30.8 t -66.33 -45.6 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.068 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.78 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -68.14 -47.21 68.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.884 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.1 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.008 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.833 ' O ' HG23 ' A' ' 442' ' ' VAL . 17.7 mmt180 -67.61 -36.64 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -66.94 -44.77 79.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.722 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.91 -34.7 76.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.672 ' HB3' HD22 ' A' ' 423' ' ' LEU . . . -70.32 -45.02 67.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.041 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.833 HG23 ' O ' ' A' ' 438' ' ' ARG . 24.9 t -62.92 -45.91 97.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.99 -34.11 74.29 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.526 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.06 -36.4 83.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.944 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.78 ' HA ' HD12 ' A' ' 448' ' ' ILE . 1.7 mm -68.42 -31.31 50.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.292 179.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.63 -47.69 83.52 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.762 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.68 -35.36 80.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.425 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.792 ' CG2' HG21 ' A' ' 397' ' ' VAL . 10.3 mt -74.58 -36.44 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.772 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.4 -55.4 35.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.687 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.07 -37.92 81.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.24 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 7.0 mtmm -57.86 -31.6 66.84 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.654 HD23 HG13 ' A' ' 397' ' ' VAL . 1.5 tm? -68.38 -38.95 81.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.393 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -60.81 -30.0 69.8 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.23 -15.74 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.131 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -22.65 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 110.837 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.68 -100.61 0.71 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.406 ' CA ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.993 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.4 m -93.94 147.75 34.04 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 120.677 0.275 . . . . 0.0 110.894 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.35 90.64 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.549 2.166 . . . . 0.0 112.294 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -137.92 -43.54 0.52 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.001 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 63.61 137.94 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.434 ' O ' ' CD ' ' A' ' 381' ' ' LYS . 13.3 p -152.02 73.55 7.79 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.362 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.602 ' CB ' ' HD3' ' A' ' 378' ' ' PRO . 5.3 Cg_exo -76.85 -63.91 0.03 OUTLIER 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 122.423 2.082 . . . . 0.0 114.611 -178.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.602 ' HD3' ' CB ' ' A' ' 377' ' ' PRO . 50.4 Cg_endo -102.76 -109.58 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 122.351 2.034 . . . . 0.0 114.414 -177.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.87 -19.95 7.71 Favored 'General case' 0 CA--C 1.519 -0.231 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.737 ' HA ' HD12 ' A' ' 383' ' ' ILE . 32.8 mm -58.71 -29.84 40.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.462 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -37.28 70.82 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.16 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -64.59 -38.19 90.16 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.028 0.442 . . . . 0.0 111.185 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 380' ' ' ILE . 16.6 mt -61.19 -35.24 64.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.328 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.629 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -75.05 -44.78 43.83 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.332 178.463 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -56.69 -49.41 75.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.918 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.752 HG21 HD11 ' A' ' 423' ' ' LEU . 8.4 p -65.69 -42.93 93.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.859 179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.587 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.57 -32.65 73.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.784 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -35.18 79.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 389' ' ' LYS . . . . . 0.4 ' CD ' ' HB3' ' A' ' 419' ' ' GLU . 0.3 OUTLIER -70.38 -44.43 68.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.62 179.446 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 387' ' ' LEU . 1.6 p -66.45 -35.91 76.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.634 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -60.16 -40.66 90.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.533 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -35.07 68.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.83 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -68.87 -43.57 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.121 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 394' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 395' ' ' GLN . 0.1 OUTLIER -68.07 -33.28 74.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.777 0.323 . . . . 0.0 110.788 179.933 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 395' ' ' GLN . . . . . 0.425 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 1.8 tt0 -66.44 -35.59 80.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -69.1 -37.56 78.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.812 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.861 HG21 ' CG2' ' A' ' 448' ' ' ILE . 16.2 t -60.61 -40.49 84.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -55.86 -32.98 64.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.053 0.454 . . . . 0.0 110.301 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.43 ' O ' ' C ' ' A' ' 400' ' ' PHE . 30.6 tt0 -88.91 -54.34 4.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.296 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.672 ' CD1' HD23 ' A' ' 412' ' ' LEU . 35.1 t80 -20.84 124.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.131 -0.94 . . . . 0.0 113.299 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.0 p -120.9 24.77 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.392 178.311 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.636 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -59.61 -171.11 0.45 Allowed Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.949 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.83 143.45 48.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.288 -0.456 . . . . 0.0 111.354 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.463 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -53.1 -26.96 18.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.225 179.41 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.88 14.6 30.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.19 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -106.64 147.81 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.886 0.374 . . . . 0.0 110.957 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.794 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 2.3 ttpt -61.17 -30.33 70.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.691 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -66.09 -29.24 69.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.144 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 52.5 t80 -70.88 -45.94 63.49 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.794 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -72.97 -30.56 63.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 118.612 -1.235 . . . . 0.0 108.568 177.716 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 39.1 tp -66.41 -40.03 89.34 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.016 177.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.672 HD23 ' CD1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.79 -47.04 87.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.613 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.527 ' HA ' HD21 ' A' ' 416' ' ' LEU . 29.8 mt-10 -70.32 -31.99 69.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.779 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.602 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.52 -41.41 98.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.712 -178.902 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.652 ' HB2' HD11 ' A' ' 393' ' ' LEU . 6.5 mmm -69.53 -44.67 70.49 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.906 0.384 . . . . 0.0 110.936 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.699 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -68.59 -36.83 79.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.158 179.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.71 ' HA ' HD23 ' A' ' 420' ' ' LEU . 95.4 m -72.03 -30.32 65.07 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.595 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -62.58 -47.45 83.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.572 -179.651 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 416' ' ' LEU . 1.2 pp20? -65.3 -46.44 80.35 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.71 HD23 ' HA ' ' A' ' 417' ' ' THR . 0.3 OUTLIER -60.55 -34.51 74.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.102 0.477 . . . . 0.0 109.877 179.303 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.35 -31.77 69.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.179 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.23 -46.41 85.95 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.376 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.914 ' O ' HG13 ' A' ' 426' ' ' VAL . 1.3 mt -70.29 -45.74 65.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.614 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 40.88 37.36 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.745 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.0 t 59.75 55.09 4.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 426' ' ' VAL . . . . . 0.914 HG13 ' O ' ' A' ' 423' ' ' LEU . 3.6 m -66.38 117.65 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.056 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.32 149.91 27.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.052 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 428' ' ' THR . . . . . 0.519 HG23 ' NH1' ' A' ' 438' ' ' ARG . 72.4 p -110.86 -27.14 8.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.994 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 106.81 -27.19 17.14 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.354 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 168.42 41.27 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.27 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.44 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -116.46 96.86 5.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 0.0 110.958 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.86 -31.79 72.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.815 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.28 -43.85 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.835 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.555 HG12 ' CD ' ' A' ' 438' ' ' ARG . 38.8 t -68.08 -37.99 79.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -40.76 87.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -66.14 -38.3 87.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.787 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.68 -38.73 73.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.027 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.875 ' O ' HG23 ' A' ' 442' ' ' VAL . 6.0 mtp180 -62.13 -44.43 96.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.81 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -66.48 -37.05 84.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.81 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.47 -39.6 88.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.917 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.47 69.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.078 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 438' ' ' ARG . 31.8 t -62.88 -44.98 99.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.84 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.5 m -60.85 -34.91 75.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.236 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -63.16 -34.62 78.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.507 HG21 ' CD2' ' A' ' 420' ' ' LEU . 3.4 mm -66.35 -36.63 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-O 121.249 0.547 . . . . 0.0 110.531 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.92 -47.72 84.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.187 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.79 87.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.082 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.861 ' CG2' HG21 ' A' ' 397' ' ' VAL . 15.7 mt -73.52 -36.54 48.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.39 -46.67 83.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.905 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -38.33 70.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.524 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.85 -30.07 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.118 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.636 HD12 ' O ' ' A' ' 448' ' ' ILE . 2.1 mt -77.58 -36.62 51.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.594 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -29.96 60.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.857 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -96.6 -12.35 24.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.332 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.53 -24.02 34.29 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.746 0.308 . . . . 0.0 110.846 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.457 ' HA2' ' HA ' ' A' ' 403' ' ' LYS . . . -92.42 -76.19 1.32 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.632 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 60.67 88.27 0.12 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.723 0.297 . . . . 0.0 110.945 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -51.67 157.13 5.66 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.534 2.156 . . . . 0.0 112.27 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -107.05 179.67 4.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.948 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -158.05 31.72 0.25 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.9 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 2.8 m 63.17 143.1 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.888 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.47 ' HA ' ' HD3' ' A' ' 378' ' ' PRO . 17.4 Cg_exo -67.69 149.01 78.81 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.576 2.184 . . . . 0.0 111.982 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 377' ' ' PRO . 14.2 Cg_exo -69.03 -8.9 24.88 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.609 2.206 . . . . 0.0 113.004 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 93.6 p -103.26 -25.45 13.33 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.724 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.683 HG22 HD11 ' A' ' 384' ' ' ILE . 27.7 mm -58.76 -29.82 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.456 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.36 -33.25 67.59 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.983 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 386' ' ' VAL . 7.0 mttm -68.23 -38.1 81.5 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.174 0.512 . . . . 0.0 110.782 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.558 HD12 HD13 ' A' ' 380' ' ' ILE . 50.2 mt -60.5 -34.14 57.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.433 178.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.683 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.94 -44.8 44.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.469 178.649 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -58.57 -49.4 77.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.084 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.761 HG11 ' HB3' ' A' ' 423' ' ' LEU . 46.8 t -68.31 -46.17 81.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.156 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.846 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.77 -34.88 78.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.21 0.529 . . . . 0.0 109.834 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -38.96 81.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.506 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 386' ' ' VAL . 24.3 t -67.3 -36.0 75.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.741 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -61.43 -41.11 96.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.664 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.82 -45.6 67.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.544 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.709 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -60.84 -38.0 83.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.59 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -60.68 -42.03 96.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.698 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -58.06 -44.82 87.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.827 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.25 -45.25 70.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.775 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 393' ' ' LEU . 58.2 t -60.64 -32.55 51.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.706 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.12 -34.72 76.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.044 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' O ' ' A' ' 400' ' ' PHE . 6.6 tt0 -91.43 -68.62 0.78 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.17 179.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.786 ' CE1' HD13 ' A' ' 412' ' ' LEU . 4.7 t80 54.55 157.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.591 0.71 . . . . 0.0 111.888 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 5.0 m -141.12 20.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.853 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.567 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -104.08 -170.46 25.12 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.889 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -134.14 143.93 48.24 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.58 -0.31 . . . . 0.0 111.68 -179.545 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 3.2 tttt -51.13 -28.77 11.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.138 179.214 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.74 14.34 32.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.391 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.19 164.97 11.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.816 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.41 -30.8 66.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.14 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.02 -29.14 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.027 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 18.5 t80 -69.38 -45.43 69.34 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.816 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.75 64.34 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.903 178.18 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -68.1 -39.33 82.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.454 177.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.786 HD13 ' CE1' ' A' ' 400' ' ' PHE . 10.0 tp -61.28 -46.85 88.64 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.33 -31.9 69.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.657 177.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 0.4 OUTLIER -63.38 -44.6 94.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.959 -179.166 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 6.3 ptp -66.29 -36.9 84.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.071 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.471 ' O ' HD12 ' A' ' 416' ' ' LEU . 8.5 tp -68.69 -41.91 78.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.493 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -32.83 73.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.843 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.55 -47.19 76.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.522 ' CD ' HD13 ' A' ' 393' ' ' LEU . 15.3 pt-20 -66.29 -40.3 89.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.902 0.382 . . . . 0.0 110.704 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.853 HD22 HD11 ' A' ' 423' ' ' LEU . 1.0 OUTLIER -66.46 -33.58 76.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.094 0.473 . . . . 0.0 110.381 179.561 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.64 -31.79 68.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.102 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -46.52 73.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.32 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 1.03 HD22 ' HB1' ' A' ' 441' ' ' ALA . 3.3 pp -65.24 -31.18 72.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.339 . . . . 0.0 110.939 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 424' ' ' ASP . . . . . 0.625 ' N ' HD12 ' A' ' 423' ' ' LEU . 12.4 t70 -70.09 -26.82 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 1.8 t -57.96 -25.92 61.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.159 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 23.7 t -66.63 134.86 29.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.89 0.376 . . . . 0.0 111.098 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -101.82 -177.79 3.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -151.13 138.38 19.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.86 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.87 28.27 16.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.547 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 97.16 43.68 2.97 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.467 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.695 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.3 mm-40 -116.43 129.05 56.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.862 0.363 . . . . 0.0 110.831 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -67.19 -37.45 83.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.34 -43.93 95.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.817 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.695 HG23 ' HB3' ' A' ' 431' ' ' GLN . 29.4 t -60.64 -46.1 96.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.08 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -34.3 74.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.782 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -64.71 -34.31 78.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.829 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.56 -43.64 69.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.155 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.776 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.3 mmp_? -61.89 -44.53 96.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.924 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.49 -43.09 99.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.012 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.45 -45.0 95.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.074 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 1.03 ' HB1' HD22 ' A' ' 423' ' ' LEU . . . -70.88 -45.58 64.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.319 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 438' ' ' ARG . 38.5 t -69.37 -30.7 46.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.025 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 54.1 t -70.66 -43.09 69.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.78 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.83 -44.58 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.062 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.85 HG12 HD23 ' A' ' 420' ' ' LEU . 2.8 pp -63.27 -31.12 51.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.765 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.609 ' N ' HD12 ' A' ' 445' ' ' ILE . 5.8 tp-100 -64.48 -46.57 82.48 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.631 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -58.97 -36.79 75.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.682 HG22 HG11 ' A' ' 397' ' ' VAL . 24.4 mt -66.78 -36.53 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.9 tt -57.64 -58.71 7.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.813 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.94 -38.05 81.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.415 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.4 mmpp? -57.94 -29.88 65.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.636 ' HG ' HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -71.33 -38.86 71.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.525 179.311 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.68 -29.98 65.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.121 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -20.7 23.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -20.6 36.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.768 0.318 . . . . 0.0 110.981 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.46 -90.33 0.18 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.329 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 112.447 -0.261 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.425 ' CB ' ' HD3' ' A' ' 373' ' ' PRO . 0.5 OUTLIER -72.44 -51.51 7.41 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.63 0.252 . . . . 0.0 110.958 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 373' ' ' PRO . . . . . 0.425 ' HD3' ' CB ' ' A' ' 372' ' ' SER . 21.8 Cg_exo -64.84 82.4 0.18 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.603 2.202 . . . . 0.0 112.146 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 60.77 157.82 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.75 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -117.37 -60.73 1.79 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.856 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -104.17 142.59 24.92 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.788 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.583 ' CG ' HD13 ' A' ' 380' ' ' ILE . 35.0 Cg_exo -59.56 -175.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.356 2.037 . . . . 0.0 111.947 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.416 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 74.5 Cg_endo -90.43 10.72 2.87 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.722 2.281 . . . . 0.0 113.579 -179.216 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -124.66 -29.94 3.38 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.956 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.662 HG22 HD11 ' A' ' 384' ' ' ILE . 1.7 mp -58.6 -29.58 39.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.443 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.8 OUTLIER -56.94 -33.85 67.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.252 -179.517 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -68.43 -38.11 80.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.127 0.489 . . . . 0.0 110.827 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.691 HG13 HG13 ' A' ' 434' ' ' VAL . 40.7 mm -60.52 -33.98 56.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.524 178.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.662 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.94 -44.78 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.584 178.582 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 385' ' ' HIS . . . . . 0.415 ' CG ' ' N ' ' A' ' 386' ' ' VAL . 0.0 OUTLIER -59.26 -49.47 77.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.511 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.904 HG21 ' HG ' ' A' ' 423' ' ' LEU . 14.7 p -64.0 -43.5 97.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.59 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.448 ' N ' HG13 ' A' ' 386' ' ' VAL . 2.2 tt -60.7 -34.43 74.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.384 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 388' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 3.2 mt-10 -62.8 -35.01 78.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.519 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 -34.48 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.55 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.452 HG13 HG22 ' A' ' 445' ' ' ILE . 22.5 t -61.63 -46.85 95.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.488 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.6 pt20 -64.98 -35.51 81.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.836 0.35 . . . . 0.0 110.797 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -40.8 74.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.632 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.545 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -64.0 -41.7 97.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.618 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.21 -38.54 83.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.22 -35.34 80.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.826 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -69.27 -39.9 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 393' ' ' LEU . 23.5 t -60.71 -44.85 98.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.028 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -55.76 -40.32 72.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 400' ' ' PHE . 15.3 tt0 -78.19 -53.93 6.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.304 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.604 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 35.1 t80 -22.65 123.28 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.09 -0.959 . . . . 0.0 113.145 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 401' ' ' VAL . 11.6 p -118.33 24.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.444 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.604 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -61.09 -169.37 0.58 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.941 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.556 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 0.3 OUTLIER -133.7 143.64 48.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.498 . . . . 0.0 111.17 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.406 ' N ' ' HA3' ' A' ' 456' ' ' GLY . 0.2 OUTLIER -50.16 -27.99 6.7 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.593 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.87 11.99 19.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 29.8 t70 -93.5 154.61 17.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 110.963 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -32.72 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.557 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -63.0 -45.9 90.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.897 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.556 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 11.8 t80 -61.34 -44.53 97.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.919 0.39 . . . . 0.0 110.672 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.481 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -59.13 -48.65 80.84 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.2 tp -65.01 -38.47 91.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.76 HD12 HD13 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.04 -47.43 86.43 Favored 'General case' 0 C--N 1.339 0.113 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -70.68 -32.29 69.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.572 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.6 mt-10 -63.7 -39.65 94.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.838 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 1.6 ttt -69.45 -42.01 75.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.959 0.409 . . . . 0.0 110.167 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.69 HD12 HD12 ' A' ' 449' ' ' LEU . 0.9 OUTLIER -61.04 -40.41 93.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.549 179.548 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.578 ' HA ' HD21 ' A' ' 420' ' ' LEU . 2.7 m -64.13 -32.97 74.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.446 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.725 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -73.12 -23.58 60.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.891 ' HG2' HG21 ' A' ' 445' ' ' ILE . 0.4 OUTLIER -72.81 -46.64 52.08 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.056 -179.748 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.812 ' HB2' HG13 ' A' ' 442' ' ' VAL . 0.8 OUTLIER -64.79 -50.19 67.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.242 -178.965 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.981 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -64.29 -31.38 72.57 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.176 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 422' ' ' GLU . . . . . 0.981 ' N ' HD13 ' A' ' 421' ' ' LEU . 5.3 tp10 -64.25 -38.77 92.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.904 ' HG ' HG21 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -73.83 -31.19 63.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.007 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -74.16 -28.15 61.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.966 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 83.1 p -98.69 39.73 1.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 426' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 423' ' ' LEU . 23.8 t -101.07 136.74 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.35 138.8 58.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.9 p -153.94 163.7 39.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.925 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -173.75 98.67 0.13 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.17 49.74 55.7 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.466 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.462 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.8 mt-30 -147.76 87.25 1.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.838 0.351 . . . . 0.0 110.952 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -64.58 -33.88 76.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.928 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 9.5 m -60.54 -44.74 95.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.923 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.691 HG13 HG13 ' A' ' 383' ' ' ILE . 32.6 t -66.53 -36.13 76.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.44 -39.15 85.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.861 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -69.1 -32.93 72.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.951 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.82 -45.23 62.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.237 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -62.23 -31.53 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.56 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -67.97 -37.52 81.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.885 ' HB3' HD22 ' A' ' 423' ' ' LEU . . . -61.87 -45.66 92.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.865 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.812 HG13 ' HB2' ' A' ' 420' ' ' LEU . 57.8 t -66.99 -36.31 76.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 16.0 m -70.9 -46.77 61.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.658 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -44.57 89.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.892 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.891 HG21 ' HG2' ' A' ' 419' ' ' GLU . 2.8 pp -63.21 -31.36 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.191 0.52 . . . . 0.0 110.294 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.545 ' N ' HD12 ' A' ' 445' ' ' ILE . 4.8 tp-100 -59.09 -47.73 84.19 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.586 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.13 -37.41 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.335 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.48 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.9 mt -69.08 -36.36 73.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.594 179.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.69 HD12 HD12 ' A' ' 416' ' ' LEU . 6.2 tt -57.49 -47.28 82.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.66 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -37.84 88.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.246 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -30.14 65.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.803 178.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.76 HD13 HD12 ' A' ' 412' ' ' LEU . 4.8 tp -73.09 -36.69 66.84 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.291 179.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -57.07 -29.92 63.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.477 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm -92.85 -12.45 31.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.29 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -25.48 33.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.925 0.393 . . . . 0.0 110.361 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.406 ' HA3' ' N ' ' A' ' 404' ' ' LYS . . . -76.41 -70.19 1.31 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.459 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.946 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 60.18 160.03 0.11 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.717 0.294 . . . . 0.0 110.933 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.1 171.64 14.45 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.563 2.175 . . . . 0.0 112.335 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -136.02 120.21 17.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.859 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -119.4 -72.25 0.7 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.435 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 2.8 m -105.52 133.67 20.06 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.885 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.449 ' HD2' HG13 ' A' ' 380' ' ' ILE . 32.4 Cg_exo -58.74 171.56 1.97 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.466 2.111 . . . . 0.0 112.294 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -78.38 -29.05 4.11 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 123.079 2.519 . . . . 0.0 112.952 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 29.1 t -90.15 -26.24 20.28 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.718 ' HA ' HD12 ' A' ' 383' ' ' ILE . 33.5 mm -58.76 -29.7 40.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.471 ' HA ' HG12 ' A' ' 384' ' ' ILE . 4.0 mtpt -57.03 -33.19 66.95 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.019 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.535 ' O ' HG23 ' A' ' 386' ' ' VAL . 17.2 mttt -66.7 -38.05 85.97 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.196 0.522 . . . . 0.0 110.841 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.718 HD12 ' HA ' ' A' ' 380' ' ' ILE . 18.9 mt -60.5 -35.74 65.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.308 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.639 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -75.03 -44.65 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.592 178.53 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -58.08 -49.38 77.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.893 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.548 HG11 ' HB3' ' A' ' 423' ' ' LEU . 41.1 t -69.23 -46.09 78.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.079 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.16 -36.46 81.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.941 0.4 . . . . 0.0 110.502 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.82 -34.76 77.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.739 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -36.36 74.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.785 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.796 HG22 ' CD ' ' A' ' 419' ' ' GLU . 15.6 t -66.84 -46.75 84.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.063 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.407 ' HG3' ' N ' ' A' ' 392' ' ' TYR . 12.4 pt20 -61.79 -37.5 84.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.627 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.407 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 15.3 t80 -72.4 -47.98 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.807 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.41 ' HB3' HD22 ' A' ' 416' ' ' LEU . 4.4 mt -60.73 -39.36 88.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 394' ' ' GLU . . . . . 0.406 ' OE1' HD11 ' A' ' 448' ' ' ILE . 47.9 tt0 -61.3 -40.66 94.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.751 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -31.83 73.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.737 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -68.79 -40.37 79.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.792 HG21 ' CG2' ' A' ' 448' ' ' ILE . 30.3 t -60.64 -40.13 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.784 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.58 -37.0 70.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.119 0.485 . . . . 0.0 110.371 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -83.57 -54.38 4.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.254 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.679 ' CE1' HD23 ' A' ' 412' ' ' LEU . 51.2 t80 -27.69 109.18 0.04 OUTLIER 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.023 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 401' ' ' VAL . 20.4 t -102.36 26.36 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.298 178.061 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.629 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -56.3 -175.91 0.25 Allowed Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.118 -179.269 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.496 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.66 48.25 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.819 -0.69 . . . . 0.0 111.511 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.444 ' HG2' ' CZ ' ' A' ' 409' ' ' TYR . 0.9 OUTLIER -53.5 -26.3 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.423 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 7.9 t -94.95 -15.48 23.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.552 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.454 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 9.2 t70 -77.44 142.29 39.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.78 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 46.2 mttm -61.71 -30.41 70.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.636 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.07 -29.08 70.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.728 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 24.3 t80 -67.77 -45.46 74.83 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.78 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.2 p-90 -72.73 -29.34 63.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.056 178.191 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.616 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.1 tp -69.54 -40.39 76.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.158 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.721 HD12 HD21 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -59.68 -46.96 87.49 Favored 'General case' 0 C--N 1.339 0.141 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.885 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.823 ' HG2' HD22 ' A' ' 452' ' ' LEU . 1.2 mt-10 -70.09 -31.52 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.521 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.6 OUTLIER -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.018 -179.181 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.49 -39.74 77.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.217 0.532 . . . . 0.0 109.896 178.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 1.067 HD12 HG23 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -60.6 -42.72 97.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.881 179.962 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.559 HG22 HD13 ' A' ' 421' ' ' LEU . 3.2 m -65.92 -32.72 74.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.689 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -47.21 84.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.569 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.796 ' CD ' HG22 ' A' ' 390' ' ' VAL . 0.0 OUTLIER -63.55 -34.55 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 0.4 OUTLIER -68.88 -41.2 78.66 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.916 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.559 HD13 HG22 ' A' ' 417' ' ' THR . 5.5 mp -70.75 -31.87 68.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.328 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 -46.55 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.943 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.548 ' HB3' HG11 ' A' ' 386' ' ' VAL . 3.1 pp -58.81 -30.7 67.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.743 0.306 . . . . 0.0 111.261 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -91.75 31.77 1.18 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.371 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.34 -17.58 8.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.446 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.4 m -66.59 137.87 24.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.792 0.33 . . . . 0.0 111.386 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -87.73 86.47 7.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 5.5 p -84.22 131.99 34.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.795 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -93.19 -76.38 1.33 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.532 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -131.61 44.52 1.2 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.415 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.412 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.9 mt-30 -106.99 92.54 4.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.825 0.345 . . . . 0.0 110.883 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -67.55 -40.39 84.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.989 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 76.6 p -58.66 -44.88 90.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.852 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.412 HG23 ' HB3' ' A' ' 431' ' ' GLN . 43.5 t -64.43 -39.89 87.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.981 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -58.88 -42.8 90.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -36.68 83.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.639 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.56 -40.61 95.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.547 ' HB3' HD13 ' A' ' 423' ' ' LEU . 0.0 OUTLIER -66.79 -44.3 81.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.9 mtpp -55.98 -35.25 66.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 110.629 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.05 -32.0 64.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.743 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.56 72.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.071 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.464 HG13 HD21 ' A' ' 420' ' ' LEU . 42.5 t -62.96 -39.21 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -38.56 85.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.517 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -35.45 80.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.353 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 1.067 HG23 HD12 ' A' ' 416' ' ' LEU . 2.5 mm -65.78 -31.2 52.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.707 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -44.45 85.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.442 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.62 -38.44 91.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.839 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.86 ' O ' HD12 ' A' ' 452' ' ' LEU . 15.9 mt -74.67 -36.29 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.878 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.573 HD12 HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.2 -51.64 68.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.675 -179.776 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.47 -33.99 77.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 0.0 110.098 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -59.65 -31.71 69.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.848 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.86 HD12 ' O ' ' A' ' 448' ' ' ILE . 0.4 OUTLIER -73.14 -36.61 66.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.448 179.265 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.21 -30.0 61.72 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.974 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -13.57 23.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.367 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -82.06 -26.26 33.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.171 0.51 . . . . 0.0 110.916 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.66 -97.97 0.74 Allowed Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.598 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.848 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.119 0 N-CA-C 112.511 -0.235 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -159.95 156.32 23.78 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.744 0.307 . . . . 0.0 110.826 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.15 177.09 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.524 2.149 . . . . 0.0 112.262 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -156.56 153.26 28.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.831 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 375' ' ' PHE . . . . . 0.403 ' CD2' ' OG1' ' A' ' 376' ' ' THR . 8.2 p90 -125.74 179.79 5.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.866 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.403 ' OG1' ' CD2' ' A' ' 375' ' ' PHE . 0.3 OUTLIER 62.56 105.38 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.828 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.418 ' HB2' HG12 ' A' ' 380' ' ' ILE . 51.2 Cg_exo -53.67 168.37 0.76 Allowed 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.46 2.107 . . . . 0.0 112.3 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -75.53 -22.0 14.35 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.99 2.46 . . . . 0.0 112.985 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.3 m -98.61 -26.58 14.34 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.868 ' O ' HG22 ' A' ' 383' ' ' ILE . 30.6 mm -58.67 -29.9 40.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.403 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.79 -33.26 66.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.865 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -65.82 -41.16 92.16 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.325 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.868 HG22 ' O ' ' A' ' 380' ' ' ILE . 5.4 tp -60.68 -32.41 51.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.573 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -75.02 -44.78 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.714 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.98 -49.36 75.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.882 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.462 ' O ' HG23 ' A' ' 390' ' ' VAL . 10.4 p -63.87 -37.34 79.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.861 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.4 tp -67.56 -37.73 83.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.67 -34.67 77.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.744 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -44.58 78.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 386' ' ' VAL . 29.0 t -63.25 -35.95 74.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.136 0.493 . . . . 0.0 110.384 179.334 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.32 -41.06 88.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.486 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.95 -42.87 99.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.303 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.637 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.0 OUTLIER -58.4 -38.08 76.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.447 179.501 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 394' ' ' GLU . . . . . 0.71 ' OE1' HD11 ' A' ' 448' ' ' ILE . 15.2 tt0 -59.37 -42.69 92.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.1 -41.1 82.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.779 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 49.3 mm-40 -69.27 -44.51 71.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.971 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.791 HG11 HG22 ' A' ' 448' ' ' ILE . 45.5 t -60.59 -33.45 54.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.532 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -57.01 -34.78 68.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.993 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.0 tt0 -89.99 -67.46 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.764 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.851 ' CD1' HD22 ' A' ' 412' ' ' LEU . 8.2 t80 43.4 111.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.805 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 9.8 m -95.76 23.6 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.157 178.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.526 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.69 -171.46 42.26 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.582 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.455 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.07 143.77 48.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.685 0.279 . . . . 0.0 111.666 -179.696 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.528 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.94 -25.56 30.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.214 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.05 0.37 37.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.436 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -92.14 149.5 21.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.34 . . . . 0.0 110.635 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.783 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.14 -30.16 70.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.852 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.82 -29.17 70.52 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.103 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.528 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.3 t80 -69.57 -45.56 68.41 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.783 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 4.8 p-90 -72.85 -30.99 64.45 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.961 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.619 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 36.6 tp -69.67 -38.4 77.03 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.471 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.851 HD22 ' CD1' ' A' ' 400' ' ' PHE . 11.2 tp -61.66 -47.34 85.81 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.86 ' CG ' HD13 ' A' ' 452' ' ' LEU . 24.7 mt-10 -70.41 -32.7 70.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.304 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.619 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mt-10 -64.01 -35.67 81.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.442 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 28.3 ttp -69.6 -40.66 76.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.653 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.835 HD21 HG21 ' A' ' 448' ' ' ILE . 1.9 mp -60.62 -45.74 92.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -33.45 75.11 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.643 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -59.41 -47.27 86.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.358 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -69.75 -38.11 76.67 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.501 HD13 HG13 ' A' ' 445' ' ' ILE . 27.9 tp -61.35 -39.47 90.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.247 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.34 -31.84 69.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.782 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -46.21 91.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.781 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.24 -35.07 77.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.824 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.12 -31.26 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.803 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.8 t -60.31 -20.79 60.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 22.7 t -66.49 116.77 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.087 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.54 113.72 25.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.959 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 7.4 t -107.87 133.21 52.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -96.24 34.64 4.82 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.482 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 108.69 69.94 0.67 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.426 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.662 ' HG2' HG23 ' A' ' 434' ' ' VAL . 3.0 tt0 -143.19 114.5 7.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.937 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -65.81 -35.27 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 42.2 t -60.14 -44.66 94.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.662 HG23 ' HG2' ' A' ' 431' ' ' GLN . 27.8 t -71.13 -42.89 75.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.995 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -67.78 -35.5 78.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.09 -35.26 76.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.853 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.13 76.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.136 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.0 OUTLIER -68.63 -43.86 75.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.935 179.971 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -59.04 -44.83 91.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.767 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -62.48 -36.28 82.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.645 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.42 76.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.002 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 438' ' ' ARG . 34.2 t -63.11 -45.9 97.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.051 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.91 -34.56 74.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.083 0.468 . . . . 0.0 110.322 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -63.18 -35.74 81.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.339 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.58 ' HA ' HD12 ' A' ' 448' ' ' ILE . 2.6 mm -66.13 -35.51 75.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.473 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -58.25 -47.78 82.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.089 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.63 -37.07 85.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.966 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.835 HG21 HD21 ' A' ' 416' ' ' LEU . 7.8 mt -74.78 -36.5 40.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.144 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.535 ' CD1' HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.39 -54.11 50.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.926 -179.473 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -38.62 91.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.354 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 451' ' ' LYS . . . . . 0.454 ' O ' ' HD2' ' A' ' 455' ' ' LYS . 3.7 mttm -57.87 -35.19 70.64 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.86 HD13 ' CG ' ' A' ' 413' ' ' GLU . 0.2 OUTLIER -66.46 -36.76 83.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.397 179.071 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.7 -29.91 70.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.789 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.71 -16.25 25.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.845 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.454 ' HD2' ' O ' ' A' ' 451' ' ' LYS . 0.3 OUTLIER -82.46 -22.6 35.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.797 0.332 . . . . 0.0 110.776 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.08 -79.77 0.67 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.374 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.401 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 20.6 p -139.17 63.67 30.37 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.832 0.349 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.21 173.06 0.24 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.566 2.178 . . . . 0.0 112.293 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -115.67 -83.48 0.62 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.97 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 62.61 -80.43 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.019 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.587 HG22 ' HD2' ' A' ' 377' ' ' PRO . 0.2 OUTLIER -137.1 142.78 39.44 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.649 -179.959 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.587 ' HD2' HG22 ' A' ' 376' ' ' THR . 78.8 Cg_exo -49.94 178.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.478 2.118 . . . . 0.0 112.597 -179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -80.43 -23.29 6.2 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 123.238 2.626 . . . . 0.0 113.484 -178.86 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 96.7 p -106.32 -26.27 11.57 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.764 HG22 HD11 ' A' ' 384' ' ' ILE . 46.0 mm -58.65 -29.81 40.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 178.489 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.438 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.09 -33.35 67.21 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.052 -179.84 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 382' ' ' LYS . . . . . 0.705 ' O ' HG23 ' A' ' 386' ' ' VAL . 47.4 mttt -68.25 -38.21 81.55 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.099 0.476 . . . . 0.0 110.873 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.761 HD12 ' HA ' ' A' ' 380' ' ' ILE . 21.6 mt -60.54 -34.98 60.35 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.399 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.764 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.97 -44.72 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.426 178.615 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.04 -49.32 76.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.768 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.8 ' HB ' HD21 ' A' ' 423' ' ' LEU . 19.9 t -67.06 -39.34 83.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.012 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 4.2 tt -67.13 -35.65 80.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.474 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 388' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.2 tt0 -62.71 -34.72 77.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.672 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.02 -34.6 73.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.424 179.704 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 386' ' ' VAL . 32.6 t -67.7 -46.87 81.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.096 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 14.4 pt20 -59.46 -41.03 88.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.946 0.403 . . . . 0.0 110.538 179.888 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.37 -37.39 77.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.231 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.799 HD21 ' HG2' ' A' ' 415' ' ' MET . 0.4 OUTLIER -64.97 -38.66 91.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.381 179.484 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 394' ' ' GLU . . . . . 0.488 ' HB2' HD11 ' A' ' 448' ' ' ILE . 7.3 tt0 -59.11 -45.07 91.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.461 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -60.98 -33.52 73.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.631 179.562 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.25 -40.7 77.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.813 179.858 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.932 HG21 ' CG2' ' A' ' 448' ' ' ILE . 24.4 t -60.68 -33.27 54.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.472 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -28.51 64.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.174 0.512 . . . . 0.0 110.135 178.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 24.3 tt0 -91.69 -53.39 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.886 179.119 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.675 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 46.1 t80 -20.78 112.64 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.231 179.823 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.8 p -104.07 26.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.619 178.243 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.675 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -58.91 -177.66 0.93 Allowed Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.781 -0.724 . . . . 0.0 113.065 -179.309 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.518 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.62 48.22 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.834 -0.683 . . . . 0.0 111.543 -179.999 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -52.56 -27.15 15.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.319 179.355 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.5 -15.55 20.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.493 -179.707 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -74.52 144.17 44.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.763 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.1 OUTLIER -62.81 -30.83 71.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.813 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.09 70.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.803 179.565 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.518 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 41.2 t80 -68.36 -45.58 72.43 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.569 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.763 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -72.94 -29.37 63.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.949 177.921 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.62 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 20.2 tp -69.61 -38.43 77.26 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.14 177.943 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.733 HD12 HD21 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.69 -47.32 85.86 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.906 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.449 ' HG3' HD13 ' A' ' 452' ' ' LEU . 3.7 tt0 -70.63 -32.26 69.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.646 177.701 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.87 -38.97 93.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.198 -179.367 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.799 ' HG2' HD21 ' A' ' 393' ' ' LEU . 50.3 ttp -69.64 -44.79 69.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.339 . . . . 0.0 110.859 -179.931 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.876 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.49 -37.11 77.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.505 179.641 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.876 ' N ' HD12 ' A' ' 416' ' ' LEU . 1.2 t -70.26 -44.28 68.77 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -61.68 -38.61 88.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.726 0.298 . . . . 0.0 110.931 -179.627 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 18.0 pt-20 -72.27 -46.33 56.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.11 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.755 ' CB ' HG21 ' A' ' 445' ' ' ILE . 1.7 pp -66.61 -34.29 77.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.5 -38.44 89.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.937 179.249 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.89 -44.3 97.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.298 179.51 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.8 HD21 ' HB ' ' A' ' 386' ' ' VAL . 82.1 mt -67.06 -38.08 85.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.708 179.582 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.04 -26.47 65.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.009 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 4.3 p -96.8 38.33 1.23 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.931 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 10.9 p -88.92 133.53 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.45 98.68 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.8 t -114.22 129.55 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.947 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -158.46 100.06 0.19 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.462 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.21 49.89 54.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.458 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.504 ' O ' HG12 ' A' ' 434' ' ' VAL . 32.4 mt-30 -152.2 108.63 3.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.867 0.365 . . . . 0.0 110.926 179.936 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.69 -28.82 68.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.5 m -59.8 -44.93 93.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.724 -179.34 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 431' ' ' GLN . 10.8 p -72.44 -35.25 51.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 111.328 -179.588 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -42.44 94.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.803 0.335 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -69.29 -32.88 72.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.503 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -71.43 -45.23 63.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.199 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.2 ptt85 -68.36 -35.08 77.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.775 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -66.24 -35.79 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.793 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.6 -45.42 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.23 95.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 438' ' ' ARG . 24.5 t -63.33 -31.34 52.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.83 -46.7 62.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.98 179.774 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -67.01 -44.69 79.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.218 -179.796 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.755 HG21 ' CB ' ' A' ' 420' ' ' LEU . 2.0 pp -63.3 -31.08 51.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.98 0.419 . . . . 0.0 110.937 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.09 -44.62 91.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.584 179.692 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.13 77.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.284 -179.963 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.932 ' CG2' HG21 ' A' ' 397' ' ' VAL . 22.0 mt -73.3 -36.59 49.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.174 -179.9 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.57 -57.64 11.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.026 -179.768 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -33.18 74.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.744 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -31.88 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.976 0.417 . . . . 0.0 110.365 179.6 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.733 HD21 HD12 ' A' ' 412' ' ' LEU . 2.7 mt -77.61 -36.63 51.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.796 179.619 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -56.04 -30.01 61.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.769 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -90.35 -22.43 21.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.737 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -19.2 39.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.031 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.03 -98.9 0.14 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.483 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.89 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 60.3 m -81.38 147.63 60.68 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.67 0.271 . . . . 0.0 110.843 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.27 -50.88 12.43 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.594 2.196 . . . . 0.0 112.384 179.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 60.09 109.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.88 -179.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -92.45 -75.9 0.47 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.129 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.21 96.91 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.676 -179.831 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.608 ' HG2' HG13 ' A' ' 380' ' ' ILE . 44.7 Cg_exo -59.27 155.85 38.32 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.568 2.178 . . . . 0.0 112.268 -179.701 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 377' ' ' PRO . 5.9 Cg_exo -78.51 -10.64 15.92 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.935 2.423 . . . . 0.0 113.354 -179.158 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 10.7 p -114.73 -27.88 7.3 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 120.675 -0.41 . . . . 0.0 112.025 -179.356 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.608 HG13 ' HG2' ' A' ' 377' ' ' PRO . 33.2 mm -58.6 -29.76 40.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.547 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.429 ' HA ' HG12 ' A' ' 384' ' ' ILE . 24.6 mttt -59.35 -33.32 71.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.811 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -68.09 -38.07 81.93 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.246 0.546 . . . . 0.0 110.764 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.571 HD12 HG13 ' A' ' 434' ' ' VAL . 40.1 mm -60.48 -33.95 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.477 178.945 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.557 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -74.94 -44.49 44.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.169 178.293 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -56.82 -45.98 81.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.696 179.688 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.453 HG13 ' N ' ' A' ' 387' ' ' LEU . 13.5 p -69.36 -44.16 80.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.695 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.941 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.3 OUTLIER -66.12 -35.11 79.62 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.745 179.87 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.81 -34.98 78.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.304 0.573 . . . . 0.0 109.526 178.784 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -67.16 -40.78 86.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.591 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.941 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -63.17 -35.62 72.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.817 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.22 -41.07 99.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.816 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -64.23 -44.96 90.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.515 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -58.69 -40.6 84.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.986 179.962 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -60.15 -39.44 86.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.944 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -36.24 82.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.132 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.48 -40.62 85.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.093 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.86 HG21 HG21 ' A' ' 448' ' ' ILE . 18.1 t -60.68 -39.19 80.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 179.891 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.65 -40.37 75.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.979 0.418 . . . . 0.0 110.388 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' C ' ' A' ' 400' ' ' PHE . 17.6 tt0 -77.34 -54.86 5.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.169 179.35 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.557 ' CE1' HD23 ' A' ' 412' ' ' LEU . 41.8 t80 -11.76 110.92 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.525 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.628 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.5 p -104.49 24.92 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.515 178.193 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.524 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -64.4 -169.05 1.71 Allowed Glycine 0 N--CA 1.442 -0.925 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.873 -179.347 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.59 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.86 143.55 48.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.351 -0.424 . . . . 0.0 111.253 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.629 ' HG2' HD23 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -52.79 -24.07 8.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.781 179.853 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 405' ' ' THR . . . . . 0.401 HG23 ' HD2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER -105.02 -5.03 21.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.521 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.563 ' OD2' ' HB3' ' A' ' 408' ' ' ALA . 24.3 t70 -77.84 156.13 30.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.788 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 41.0 mtmt -68.97 -32.87 72.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.292 179.587 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.563 ' HB3' ' OD2' ' A' ' 406' ' ' ASP . . . -62.83 -29.2 70.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 178.924 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 19.8 t80 -63.04 -45.23 93.23 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.827 -179.118 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.788 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.6 OUTLIER -72.62 -27.91 62.44 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 118.763 -1.175 . . . . 0.0 108.74 177.83 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.677 HD12 ' CE3' ' A' ' 410' ' ' TRP . 1.7 mp -66.48 -41.53 88.84 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.28 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.826 HD12 HD13 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -59.82 -46.78 88.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.813 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.403 ' CG ' ' CD2' ' A' ' 449' ' ' LEU . 2.1 tm-20 -70.23 -31.94 69.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.593 177.921 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.552 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.0 OUTLIER -63.49 -42.22 98.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.339 -179.059 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 4.1 mmt -69.53 -44.33 71.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.078 0.466 . . . . 0.0 110.622 179.622 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.571 HD21 HG21 ' A' ' 397' ' ' VAL . 4.3 mt -61.68 -44.34 97.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 23.7 m -62.58 -30.46 71.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 -179.93 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.67 ' HA ' HD12 ' A' ' 421' ' ' LEU . 14.7 mttt -64.31 -43.39 94.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.062 0.458 . . . . 0.0 110.261 179.42 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.562 ' O ' HD23 ' A' ' 423' ' ' LEU . 1.0 OUTLIER -72.73 -37.78 67.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.991 179.178 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.912 ' HG ' HG13 ' A' ' 442' ' ' VAL . 0.3 OUTLIER -66.86 -50.51 62.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.385 -179.812 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.982 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.33 -31.5 68.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.986 -179.567 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 422' ' ' GLU . . . . . 0.982 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.8 OUTLIER -59.64 -46.34 89.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.781 0.324 . . . . 0.0 110.883 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.604 ' HG ' ' HB3' ' A' ' 441' ' ' ALA . 4.3 mm? -65.4 -31.02 71.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.991 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.07 -0.82 41.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.535 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 33.8 p -79.51 -37.25 37.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.825 0.345 . . . . 0.0 110.971 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 27.6 m -74.21 133.77 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.166 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -86.56 -22.22 26.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.069 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.5 t 43.53 85.52 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.525 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.21 46.98 1.64 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.449 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 144.92 52.57 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.465 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.737 ' HG2' HG23 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -164.14 95.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.86 0.362 . . . . 0.0 110.912 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -65.87 -33.93 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.867 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 27.9 t -59.15 -37.45 77.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.737 HG23 ' HG2' ' A' ' 431' ' ' GLN . 30.8 t -74.43 -41.9 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.088 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -44.25 93.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -67.47 -35.76 79.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.046 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.408 ' CB ' ' CG2' ' A' ' 383' ' ' ILE . . . -73.11 -45.12 58.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.471 -179.767 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.764 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.1 OUTLIER -66.17 -40.11 90.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.947 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -36.12 82.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.707 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.06 -42.82 62.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.811 179.784 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 441' ' ' ALA . . . . . 0.697 ' HB2' ' CD2' ' A' ' 387' ' ' LEU . . . -62.01 -45.56 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.912 HG13 ' HG ' ' A' ' 420' ' ' LEU . 43.2 t -65.11 -46.04 92.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.966 0.412 . . . . 0.0 110.813 179.823 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 8.7 m -61.97 -35.14 77.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.522 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 444' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.1 -38.03 89.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.389 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.671 ' HA ' HD12 ' A' ' 448' ' ' ILE . 1.5 mp -67.08 -31.32 52.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.485 ' HA ' HD12 ' A' ' 449' ' ' LEU . 6.8 tp-100 -63.05 -45.79 90.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.712 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.5 -37.62 85.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.86 HG21 HG21 ' A' ' 397' ' ' VAL . 10.1 mt -70.34 -36.41 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.805 179.699 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 446' ' ' GLN . 20.0 mt -57.19 -50.22 73.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.63 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.42 -41.85 75.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 110.123 179.318 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.83 -30.04 65.44 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.544 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.826 HD13 HD12 ' A' ' 412' ' ' LEU . 11.4 tp -71.25 -36.64 71.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.323 179.249 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -56.31 -29.93 61.9 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.587 179.45 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -89.91 -17.13 28.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.904 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -22.41 35.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.717 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.09 -81.61 0.43 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.151 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.629 HD23 ' HG2' ' A' ' 404' ' ' LYS . 2.5 pp . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.947 179.851 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 23.0 t -60.69 110.35 2.85 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.504 0.192 . . . . 0.0 111.016 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.48 90.1 1.23 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.453 2.102 . . . . 0.0 112.309 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -67.43 110.5 3.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.901 179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -111.35 99.16 8.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.23 151.67 43.29 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.808 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.588 ' HD2' HD12 ' A' ' 380' ' ' ILE . 78.1 Cg_exo -51.35 -177.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.667 2.245 . . . . 0.0 112.393 179.981 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -87.98 -12.21 4.29 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.771 2.314 . . . . 0.0 113.467 -179.398 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.9 p -115.94 -21.57 9.45 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.502 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.588 HD12 ' HD2' ' A' ' 377' ' ' PRO . 3.2 mt -58.82 -30.11 41.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.609 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.444 ' HA ' HG12 ' A' ' 384' ' ' ILE . 6.5 mmmt -57.04 -33.23 67.01 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.867 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -38.09 83.69 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.154 0.502 . . . . 0.0 110.808 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.798 HG21 ' HB1' ' A' ' 437' ' ' ALA . 39.4 mm -60.44 -34.33 57.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.445 178.884 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.481 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.86 -44.72 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.396 178.517 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -57.37 -49.1 77.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.573 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.798 HG11 ' HG ' ' A' ' 423' ' ' LEU . 78.1 t -65.97 -40.74 88.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.824 179.634 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.925 ' O ' HG12 ' A' ' 390' ' ' VAL . 3.2 tt -66.01 -35.06 79.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.906 0.384 . . . . 0.0 110.622 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -34.97 78.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.905 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -67.75 -39.54 84.17 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.604 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.925 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -64.48 -35.57 74.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.483 179.635 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -41.02 97.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.349 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -67.81 -46.52 71.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.491 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.91 ' O ' HG23 ' A' ' 397' ' ' VAL . 42.7 mt -62.11 -37.97 87.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.487 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -37.36 79.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.645 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -64.04 -42.39 97.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.606 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -69.04 -40.19 78.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.715 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.91 HG23 ' O ' ' A' ' 393' ' ' LEU . 22.1 t -60.6 -36.71 72.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.672 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.61 -35.75 66.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.175 0.512 . . . . 0.0 110.107 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -90.07 -66.83 0.89 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.813 178.998 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.924 ' CE1' HD13 ' A' ' 412' ' ' LEU . 9.6 t80 31.21 108.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 179.292 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.59 ' O ' HG12 ' A' ' 401' ' ' VAL . 17.4 t -95.49 25.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.165 178.177 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.564 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -87.03 -174.83 49.15 Favored Glycine 0 N--CA 1.442 -0.914 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.683 -179.719 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.7 OUTLIER -134.21 143.69 48.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.603 -0.299 . . . . 0.0 111.755 -179.787 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.502 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.1 -25.62 32.55 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.083 179.151 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.4 m -105.33 14.51 28.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.223 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.75 151.84 24.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.763 179.831 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.739 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.1 -30.26 70.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 -179.827 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 408' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -64.4 -29.28 70.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 179.828 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.502 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 3.5 t80 -71.17 -45.67 62.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.369 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.739 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.1 p-90 -73.07 -29.62 63.09 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.849 177.908 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -69.65 -40.75 76.31 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.768 177.994 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.924 HD13 ' CE1' ' A' ' 400' ' ' PHE . 1.6 tp -61.97 -46.97 86.93 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.078 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.37 -32.2 69.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.758 177.961 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.58 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.3 mm-40 -63.61 -38.66 91.95 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.91 -179.485 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.454 ' CE ' HD22 ' A' ' 393' ' ' LEU . 42.9 ttp -69.6 -41.59 75.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.994 0.426 . . . . 0.0 110.28 179.332 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.43 HD11 HG22 ' A' ' 445' ' ' ILE . 10.3 tp -62.29 -45.1 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.684 179.661 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.44 HG22 HD13 ' A' ' 421' ' ' LEU . 2.0 m -62.73 -32.59 73.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.712 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -61.46 -42.82 99.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.537 179.662 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -67.49 -46.4 73.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.282 179.614 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.938 HD21 HG22 ' A' ' 442' ' ' VAL . 2.7 tm? -59.87 -38.53 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.441 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.44 HD13 HG22 ' A' ' 417' ' ' THR . 1.9 mp -64.88 -31.8 73.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.56 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.07 -46.27 88.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.798 ' HG ' HG11 ' A' ' 386' ' ' VAL . 37.3 mt -65.34 -33.99 77.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.869 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -5.18 54.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.3 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 32.2 t -89.37 10.64 21.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.609 0.242 . . . . 0.0 111.374 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 30.0 t -93.54 115.6 32.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.855 0.36 . . . . 0.0 110.912 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -82.14 87.69 6.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.905 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 9.9 t -73.79 149.81 41.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.845 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -127.66 41.31 1.61 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.518 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.11 -27.47 4.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.528 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.652 ' CG ' HG23 ' A' ' 434' ' ' VAL . 47.7 tp60 -58.53 92.48 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 0.0 111.043 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -66.44 -29.71 69.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.1 m -57.74 -44.15 85.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.984 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.652 HG23 ' CG ' ' A' ' 431' ' ' GLN . 29.5 t -64.86 -36.88 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.061 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -62.18 -40.91 97.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.858 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -36.13 77.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.798 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -70.87 -45.19 64.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.105 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 442' ' ' VAL . 4.4 ptt180 -69.22 -35.06 75.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -65.46 -39.58 92.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.513 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.27 -38.0 89.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.566 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.0 -42.23 98.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.801 179.812 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.938 HG22 HD21 ' A' ' 420' ' ' LEU . 11.8 t -62.97 -32.51 56.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.833 179.83 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.67 -40.59 72.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.777 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -72.97 -44.59 60.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.856 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.704 HD12 ' N ' ' A' ' 446' ' ' GLN . 2.8 pp -64.66 -31.09 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.076 0.465 . . . . 0.0 110.624 179.575 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.704 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -66.15 -44.03 85.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.449 179.7 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.3 -37.35 80.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.948 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.501 HG22 HG11 ' A' ' 397' ' ' VAL . 29.7 mt -70.99 -36.51 63.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.863 179.737 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -53.22 60.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.942 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.99 -41.07 91.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.466 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.79 -30.6 65.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.935 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.59 ' CD1' HD23 ' A' ' 412' ' ' LEU . 4.1 tp -70.37 -36.48 74.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.334 179.124 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -29.73 61.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.598 179.565 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.5 -12.19 30.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.475 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -25.55 33.53 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.896 0.379 . . . . 0.0 110.484 179.708 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.39 -73.7 1.15 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.395 179.936 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.416 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.852 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.166 0 N-CA-C 112.525 -0.23 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 61.19 77.19 0.37 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.797 0.332 . . . . 0.0 110.921 179.955 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -68.15 -12.6 35.6 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.507 2.138 . . . . 0.0 112.461 179.831 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 68.7 -68.72 0.17 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.096 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -147.59 142.04 26.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.846 0.355 . . . . 0.0 110.964 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.407 HG22 ' HE2' ' A' ' 381' ' ' LYS . 0.2 OUTLIER 53.27 64.25 7.23 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.967 -179.969 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.533 ' HG2' HG13 ' A' ' 380' ' ' ILE . 52.7 Cg_exo -55.95 172.54 0.55 Allowed 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.614 2.21 . . . . 0.0 112.158 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 378' ' ' PRO . . . . . 0.439 ' HD2' ' HB3' ' A' ' 377' ' ' PRO . 23.0 Cg_endo -63.98 -78.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.533 2.155 . . . . 0.0 113.896 -178.819 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -22.36 66.4 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.34 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.712 HG22 HD11 ' A' ' 384' ' ' ILE . 31.8 mm -58.75 -29.93 41.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.773 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.45 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -56.92 -33.27 66.78 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.583 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.34 -37.93 81.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.19 0.519 . . . . 0.0 110.473 179.473 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.481 HG21 ' HB1' ' A' ' 437' ' ' ALA . 19.4 mm -60.31 -33.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.441 178.997 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.712 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.88 -44.68 44.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.471 178.493 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.42 -49.36 77.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.686 179.898 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.887 HG11 ' HB3' ' A' ' 423' ' ' LEU . 77.6 t -65.94 -43.95 92.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.753 179.673 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.44 -35.8 78.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.898 0.38 . . . . 0.0 110.505 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 388' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 4.5 mt-10 -62.79 -34.92 78.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.232 0.539 . . . . 0.0 109.637 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.25 -34.52 72.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.569 179.669 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 386' ' ' VAL . 36.8 t -62.42 -46.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.455 -179.714 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.8 pt20 -64.32 -36.34 83.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -34.99 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.188 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.897 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -68.0 -37.91 82.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.261 179.429 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -39.1 79.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.615 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -39.2 80.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.458 179.659 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.4 -44.58 71.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.223 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 393' ' ' LEU . 21.8 t -60.82 -47.49 93.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.414 -179.584 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.66 -29.91 64.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.696 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -87.57 -57.63 2.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.975 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.575 ' CE1' ' HG ' ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.76 128.75 36.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.905 -179.853 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 402' ' ' GLY . 29.4 m -124.37 40.55 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.414 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.526 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.97 -163.44 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.002 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.24 143.67 49.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.01 0.433 . . . . 0.0 111.44 -179.354 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.461 ' HA ' ' CE1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.23 -24.48 27.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.861 -179.888 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.69 14.03 24.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.352 -179.797 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.546 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t0 -95.62 154.07 17.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.37 . . . . 0.0 111.171 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -71.36 -43.48 66.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.704 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.94 -33.1 74.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.535 179.682 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.53 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 4.0 t80 -67.59 -44.24 78.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.287 179.634 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.432 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -56.01 -48.44 75.9 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.43 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -60.11 -37.96 81.58 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.111 176.968 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.575 ' HG ' ' CE1' ' A' ' 400' ' ' PHE . 0.1 OUTLIER -59.4 -47.73 84.33 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.483 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -71.02 -32.64 69.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.53 177.432 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.16 -46.5 83.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 114.992 -1.003 . . . . 0.0 111.644 -179.312 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.533 ' HE2' HD13 ' A' ' 412' ' ' LEU . 5.5 ptt? -64.56 -39.68 94.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.744 0.306 . . . . 0.0 110.856 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.719 HD23 HD22 ' A' ' 393' ' ' LEU . 3.4 tm? -60.69 -38.41 84.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.926 0.393 . . . . 0.0 110.708 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.527 ' O ' HD13 ' A' ' 421' ' ' LEU . 1.3 m -67.54 -38.53 84.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.114 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.09 -40.92 82.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.004 -179.853 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.447 ' HG3' HD11 ' A' ' 393' ' ' LEU . 0.9 OUTLIER -63.5 -46.34 86.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.013 0.435 . . . . 0.0 110.136 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.811 ' CD2' HG22 ' A' ' 442' ' ' VAL . 2.7 tm? -62.14 -37.34 84.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.442 179.422 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 417' ' ' THR . 7.3 mp -70.5 -31.8 69.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -46.39 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.141 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.887 ' HB3' HG11 ' A' ' 386' ' ' VAL . 4.2 pp -67.91 -30.76 70.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.12 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 424' ' ' ASP . . . . . 0.807 ' N ' HD12 ' A' ' 423' ' ' LEU . 4.1 t70 -83.92 11.33 7.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.595 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 26.9 t -100.27 -19.02 16.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.682 0.277 . . . . 0.0 111.359 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 426' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 423' ' ' LEU . 29.8 m -66.61 137.84 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.903 0.382 . . . . 0.0 111.167 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.86 149.04 29.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.931 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -148.06 118.08 7.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.927 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -78.52 -50.89 5.86 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.985 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -172.22 35.97 0.15 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.421 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 431' ' ' GLN . . . . . 0.438 ' CD ' HG23 ' A' ' 434' ' ' VAL . 0.7 OUTLIER -97.28 102.59 14.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.875 0.369 . . . . 0.0 110.895 -179.968 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -60.14 -30.53 69.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.886 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -44.86 92.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.857 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.438 HG23 ' CD ' ' A' ' 431' ' ' GLN . 23.4 t -75.11 -42.48 44.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.985 179.93 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -63.08 -39.68 95.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.821 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 436' ' ' GLN . . . . . 0.412 ' HA ' ' HG2' ' A' ' 439' ' ' LYS . 2.5 tt0 -68.08 -37.58 81.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.481 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.08 -34.53 66.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.224 -179.867 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.442 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.1 OUTLIER -69.83 -44.53 69.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.799 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 439' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 436' ' ' GLN . 0.0 OUTLIER -64.65 -31.5 72.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 110.509 179.661 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 440' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 8.7 tp10 -65.89 -40.06 91.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.52 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.58 92.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.631 179.7 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.811 HG22 ' CD2' ' A' ' 420' ' ' LEU . 12.3 t -62.95 -30.88 50.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.772 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -45.67 65.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.944 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -44.14 96.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.533 HG12 ' HA ' ' A' ' 442' ' ' VAL . 34.3 pt -64.8 -31.22 52.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.043 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.435 ' N ' HG13 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -62.8 -40.95 98.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.223 179.733 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.5 ' HB1' ' HZ1' ' A' ' 451' ' ' LYS . . . -66.51 -35.63 80.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.36 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.86 ' CG2' HG21 ' A' ' 397' ' ' VAL . 19.3 mt -74.8 -36.67 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.665 179.489 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.61 -47.54 81.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.626 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.2 -40.95 90.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.302 179.477 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 451' ' ' LYS . . . . . 0.5 ' HZ1' ' HB1' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -57.79 -30.11 65.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.086 0.47 . . . . 0.0 109.894 178.956 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.793 ' HG ' HG13 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -76.25 -36.73 58.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.416 179.392 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -41.53 93.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -78.96 -20.99 47.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.186 -179.96 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.411 ' HE3' HG12 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -82.42 -19.97 37.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.33 -88.44 0.35 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.478 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.203 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 77.7 p -169.63 81.51 0.64 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.72 0.295 . . . . 0.0 110.859 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.89 154.56 67.11 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.503 2.135 . . . . 0.0 112.247 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -59.62 163.23 4.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -91.59 50.01 1.66 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 376' ' ' THR . . . . . 0.763 HG22 ' HD2' ' A' ' 377' ' ' PRO . 0.2 OUTLIER -76.51 146.88 77.9 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 179.981 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.763 ' HD2' HG22 ' A' ' 376' ' ' THR . 42.4 Cg_endo -65.14 178.7 1.81 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.768 2.312 . . . . 0.0 112.492 179.889 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -92.92 -60.19 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.099 2.533 . . . . 0.0 113.191 -179.657 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 15.5 t -86.75 -32.71 20.26 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 120.653 0.263 . . . . 0.0 111.611 -179.215 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 380' ' ' ILE . . . . . 0.746 ' HB ' ' CG ' ' A' ' 377' ' ' PRO . 3.0 mp -58.66 -29.53 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.704 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 381' ' ' LYS . . . . . 0.508 ' NZ ' HG21 ' A' ' 376' ' ' THR . 0.0 OUTLIER -56.8 -33.4 66.63 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.796 179.838 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -68.32 -37.97 81.08 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.221 0.534 . . . . 0.0 110.505 179.606 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 383' ' ' ILE . . . . . 0.857 HD11 HG13 ' A' ' 434' ' ' VAL . 48.6 mt -60.45 -33.96 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.408 178.827 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 384' ' ' ILE . . . . . 0.709 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.95 -44.67 44.51 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.194 178.424 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -59.49 -49.34 78.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.602 179.721 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 386' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 390' ' ' VAL . 13.7 p -63.83 -35.45 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.368 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.9 tt -67.44 -34.29 76.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.262 179.454 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 388' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 0.3 OUTLIER -62.76 -35.15 78.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.601 179.017 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -35.43 73.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.569 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 386' ' ' VAL . 32.9 t -69.25 -46.82 76.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 388' ' ' GLU . 14.8 pt20 -58.36 -37.99 76.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.661 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -67.19 -42.86 83.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.435 179.556 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 393' ' ' LEU . . . . . 0.819 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -64.34 -37.92 89.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.332 179.368 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -39.16 81.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.542 179.653 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -63.12 -43.22 99.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.46 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.22 -42.07 76.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.492 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 397' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 393' ' ' LEU . 50.7 t -60.63 -32.17 50.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.398 179.472 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.7 -40.04 86.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.973 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.406 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.9 tt0 -86.51 -68.77 0.72 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.846 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.824 ' CD1' HD22 ' A' ' 412' ' ' LEU . 4.5 t80 57.13 144.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.16 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 401' ' ' VAL . . . . . 0.529 ' O ' HG12 ' A' ' 401' ' ' VAL . 11.9 t -125.98 21.62 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.916 178.701 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 402' ' ' GLY . . . . . 0.601 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -110.93 179.37 20.02 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.472 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 403' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.34 151.43 51.23 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.363 -0.419 . . . . 0.0 111.713 -179.618 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 404' ' ' LYS . . . . . 0.555 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.5 -31.91 25.58 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.128 179.233 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 8.9 t -97.2 15.67 22.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.196 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 406' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 1.8 t70 -115.23 155.06 27.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.848 0.356 . . . . 0.0 110.959 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 407' ' ' LYS . . . . . 0.79 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 4.0 mtmp? -61.72 -30.04 70.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.891 179.742 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.83 -29.24 70.58 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 409' ' ' TYR . . . . . 0.555 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 10.7 t80 -70.55 -45.81 64.77 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -178.61 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 410' ' ' TRP . . . . . 0.79 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -72.94 -29.12 62.86 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 118.804 -1.158 . . . . 0.0 108.888 177.979 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 411' ' ' LEU . . . . . 0.592 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 33.3 tp -69.59 -38.66 77.43 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.258 178.091 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.824 HD22 ' CD1' ' A' ' 400' ' ' PHE . 11.6 tp -62.15 -47.17 85.75 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.796 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.49 -32.14 69.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.732 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 414' ' ' GLU . . . . . 0.592 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.62 -46.59 85.04 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -178.982 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 415' ' ' MET . . . . . 0.583 ' HG3' HD12 ' A' ' 416' ' ' LEU . 2.5 ptt? -64.47 -38.72 92.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 110.272 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.643 HD13 ' O ' ' A' ' 412' ' ' LEU . 8.7 mp -68.88 -37.17 78.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.632 179.233 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.449 ' HA ' HD23 ' A' ' 420' ' ' LEU . 81.4 m -67.15 -35.67 80.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -179.257 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.463 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.1 OUTLIER -72.16 -34.54 68.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.573 0.225 . . . . 0.0 111.594 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 419' ' ' GLU . . . . . 0.753 ' OE1' HD22 ' A' ' 393' ' ' LEU . 9.0 pt-20 -72.2 -41.99 66.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.675 0.274 . . . . 0.0 111.043 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 420' ' ' LEU . . . . . 0.578 HD11 HD12 ' A' ' 421' ' ' LEU . 1.2 pp -67.49 -38.19 83.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.822 0.344 . . . . 0.0 110.755 179.941 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 421' ' ' LEU . . . . . 0.578 HD12 HD11 ' A' ' 420' ' ' LEU . 0.6 OUTLIER -68.32 -33.24 73.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.711 179.807 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -40.3 95.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.778 179.869 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -31.9 65.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.801 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -31.47 72.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.804 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 40.4 t -59.63 -26.47 65.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 40.6 t -66.63 126.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.23 176.43 7.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 3.9 t -162.59 160.28 25.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.864 179.968 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -146.87 85.91 0.17 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 65.49 28.26 73.4 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.481 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -106.81 94.47 5.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.804 0.335 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.99 -33.65 72.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -39.62 94.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.881 179.92 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 434' ' ' VAL . . . . . 0.857 HG13 HD11 ' A' ' 383' ' ' ILE . 24.5 t -76.04 -46.17 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.104 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.04 -40.32 95.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.842 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -69.32 -35.18 75.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.935 179.907 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.52 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.2 -45.18 57.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.456 -179.738 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 438' ' ' ARG . . . . . 0.415 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -67.55 -40.02 84.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.884 -179.87 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.46 -44.87 85.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.026 0.441 . . . . 0.0 110.355 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -61.52 -31.6 71.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.285 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.28 -38.8 91.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.876 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 442' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 438' ' ' ARG . 26.8 t -62.64 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 443' ' ' CYS . . . . . 0.645 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.3 m -60.7 -30.01 69.68 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 444' ' ' LYS . . . . . 0.409 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.55 -41.6 98.43 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.769 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 445' ' ' ILE . . . . . 0.602 ' N ' HD13 ' A' ' 445' ' ' ILE . 0.6 OUTLIER -73.67 -35.26 43.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.508 0.671 . . . . 0.0 109.821 178.669 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 446' ' ' GLN . . . . . 0.645 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.4 OUTLIER -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.285 179.438 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.47 -40.45 86.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.121 179.699 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 448' ' ' ILE . . . . . 0.568 HG22 HG11 ' A' ' 397' ' ' VAL . 10.1 mt -72.75 -36.15 51.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.21 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -41.54 78.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.027 -179.198 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.5 -42.77 67.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -29.97 65.62 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.612 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.511 ' CG ' HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -71.32 -36.64 71.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.677 179.349 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.16 -29.86 61.4 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.41 -8.92 26.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.824 -179.809 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 452' ' ' LEU . 0.3 OUTLIER -82.52 -26.0 32.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 110.872 179.866 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -83.65 -73.57 1.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.276 -179.999 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.865 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 56.3 p . . . . . 0 CA--C 1.519 -0.224 0 CA-C-O 120.676 0.274 . . . . 0.0 111.485 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.654 HG22 HD11 ' A' ' 384' ' ' ILE . 37.7 mm -58.68 -29.75 40.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.492 ' HA ' HG12 ' A' ' 384' ' ' ILE . 30.4 mttp -56.71 -33.23 66.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.688 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.0 OUTLIER -67.18 -37.95 84.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.078 0.466 . . . . 0.0 110.773 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.44 -34.71 58.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.483 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.654 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.9 -44.68 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.316 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.31 -43.72 88.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.279 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 382' ' ' LYS . 42.5 t -70.31 -42.91 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.63 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.911 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -66.09 -35.09 79.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 179.657 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.86 -34.96 78.45 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -40.85 87.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.548 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.911 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -63.59 -35.54 73.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -40.97 98.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.513 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -70.44 -35.53 73.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.504 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.76 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.9 OUTLIER -65.22 -38.56 90.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.516 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.66 -46.88 87.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.543 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.96 -32.52 73.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.603 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -38.25 78.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.935 HG21 ' CG2' ' A' ' 448' ' ' ILE . 21.7 t -60.69 -41.98 90.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.858 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -55.63 -34.55 65.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.02 0.438 . . . . 0.0 110.468 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -84.45 -54.34 4.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.153 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.597 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.8 t80 -27.42 112.55 0.06 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.001 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.9 p -105.13 26.81 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.53 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.597 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -57.64 -170.22 0.18 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.173 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.95 143.88 48.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.217 -0.492 . . . . 0.0 111.486 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -30.56 3.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.068 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.8 t -115.48 15.77 16.68 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.485 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 0.3 OUTLIER -83.11 150.49 26.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.871 0.367 . . . . 0.0 110.859 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.534 ' O ' HD23 ' A' ' 411' ' ' LEU . 9.8 mmtm -63.41 -30.66 71.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.213 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -73.17 -38.86 66.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.967 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.535 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 16.7 t80 -60.12 -44.36 94.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.566 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.462 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -58.92 -48.82 80.1 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.653 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.587 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -64.27 -38.05 89.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.746 ' O ' HD12 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -59.58 -47.56 85.08 Favored 'General case' 0 CA--C 1.523 -0.089 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -32.64 69.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.223 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.587 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.18 -46.4 84.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.233 -179.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.717 ' SD ' HD21 ' A' ' 393' ' ' LEU . 17.3 ptp -62.85 -40.37 97.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.816 0.341 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 412' ' ' LEU . 1.3 mt -63.33 -48.15 79.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.449 . . . . 0.0 110.541 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.7 m -64.82 -30.39 71.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -62.19 -47.3 85.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.129 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.453 ' OE2' HG23 ' A' ' 390' ' ' VAL . 3.8 pt-20 -63.58 -34.81 78.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.027 0.442 . . . . 0.0 110.14 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.921 HD23 HD11 ' A' ' 423' ' ' LEU . 0.4 OUTLIER -69.01 -33.94 74.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.037 179.217 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.4 mp -70.34 -31.87 69.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.995 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.44 -46.38 60.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.814 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.921 HD11 HD23 ' A' ' 420' ' ' LEU . 4.5 pp -68.47 -30.82 69.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.96 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . 0.677 ' N ' HD12 ' A' ' 423' ' ' LEU . 15.6 t70 -92.68 29.74 1.7 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.217 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.3 t -109.24 -17.16 13.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.958 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 13.5 m -66.59 137.34 25.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . 0.49 ' O ' HG22 ' A' ' 428' ' ' THR . 0.3 OUTLIER -84.12 -46.75 11.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.947 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 427' ' ' GLU . 14.8 t 45.47 -167.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.358 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -169.65 -51.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.577 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.94 36.18 2.1 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.494 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.502 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.9 OUTLIER -103.84 103.27 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.906 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.5 -39.69 85.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -40.95 86.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.502 HG23 ' HB3' ' A' ' 431' ' ' GLN . 39.1 t -69.8 -46.28 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.165 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -39.33 83.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.012 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -69.15 -45.12 70.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.141 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -69.11 -37.58 78.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.291 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.856 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.0 OUTLIER -63.86 -44.55 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.052 -179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 34.1 tttp -67.96 -43.17 79.64 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.197 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -64.08 -39.41 94.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.1 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.59 86.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.22 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.888 HG22 HD21 ' A' ' 420' ' ' LEU . 20.3 t -62.64 -35.45 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.86 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 6.8 m -63.08 -36.05 82.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.436 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -64.39 -41.71 96.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.706 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.92 HG21 HD12 ' A' ' 420' ' ' LEU . 2.2 mp -63.36 -31.17 51.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -41.73 90.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.691 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.19 91.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.071 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.935 ' CG2' HG21 ' A' ' 397' ' ' VAL . 34.0 mt -73.61 -36.53 47.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.142 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.613 HD12 HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.5 -44.76 85.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.971 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.12 -40.93 67.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.852 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -30.93 66.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 110.067 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.545 HD11 HD12 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -77.58 -36.64 51.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.565 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -56.15 -30.0 61.55 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.805 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 10.5 pttt -90.37 -16.58 28.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.266 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -82.46 -23.5 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.668 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.57 -91.87 0.23 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.478 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.873 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 CA--C 1.519 -0.234 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.837 ' HA ' HD12 ' A' ' 383' ' ' ILE . 36.8 mm -58.65 -30.06 40.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.41 ' HA ' HG12 ' A' ' 384' ' ' ILE . 10.0 mmtp -56.8 -33.26 66.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -68.38 -39.85 81.61 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 111.218 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 1.019 HG21 ' HB1' ' A' ' 437' ' ' ALA . 4.4 mt -60.6 -31.79 49.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.673 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.72 HD11 HG22 ' A' ' 380' ' ' ILE . 0.4 OUTLIER -74.77 -44.3 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.44 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.16 178.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -56.37 -46.19 80.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.279 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.418 ' O ' HG23 ' A' ' 390' ' ' VAL . 96.6 t -68.44 -37.3 77.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.138 178.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 383' ' ' ILE . 0.2 OUTLIER -67.52 -35.19 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.256 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -62.8 -35.0 78.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.67 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -38.81 88.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.285 179.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 386' ' ' VAL . 24.2 t -69.74 -35.89 67.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.635 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -40.87 83.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.655 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -40.77 84.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.456 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.868 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -64.82 -40.99 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.498 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -59.86 -35.33 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -49.2 74.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -69.25 -45.11 70.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.99 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.902 HG11 HD11 ' A' ' 452' ' ' LEU . 23.6 t -61.38 -32.3 52.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 110.542 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -56.66 -37.05 70.26 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.239 0.543 . . . . 0.0 109.861 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -86.73 -67.7 0.8 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.671 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.896 ' CD1' HD22 ' A' ' 412' ' ' LEU . 4.0 t80 58.92 142.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.142 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.596 ' O ' HG12 ' A' ' 401' ' ' VAL . 18.0 t -123.92 20.68 4.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.093 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.528 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -115.89 178.57 17.62 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.402 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.458 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -134.19 157.03 47.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.884 0.373 . . . . 0.0 111.603 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.604 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.5 -31.71 56.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.661 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.6 t -89.77 9.48 27.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.791 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.458 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 1.8 m-20 -115.09 164.81 13.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.336 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.731 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.8 mmtm -69.66 -29.87 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.482 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -62.54 -29.23 70.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.579 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.604 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 22.9 t80 -71.64 -45.89 60.68 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.129 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.731 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.9 OUTLIER -73.14 -31.59 64.37 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.716 177.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.3 tp -67.8 -38.41 83.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.046 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.896 HD22 ' CD1' ' A' ' 400' ' ' PHE . 21.3 tp -60.85 -47.28 87.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -70.67 -32.02 69.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.795 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.57 -46.21 86.95 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.008 -179.112 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.613 ' CE ' HD12 ' A' ' 412' ' ' LEU . 8.2 ptt? -64.49 -37.56 87.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.977 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.632 HD12 ' O ' ' A' ' 416' ' ' LEU . 5.0 tp -65.95 -37.19 85.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.253 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 29.8 m -62.53 -40.35 96.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.888 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -60.52 -47.31 86.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.854 0.359 . . . . 0.0 110.489 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.717 ' OE1' HD13 ' A' ' 393' ' ' LEU . 14.7 pt-20 -72.17 -35.83 69.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.2 0.524 . . . . 0.0 109.809 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 1.044 HD12 HD12 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -61.97 -39.56 92.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.979 179.162 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.574 ' N ' HD23 ' A' ' 420' ' ' LEU . 1.7 tp -70.72 -31.79 68.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.073 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.04 -46.52 89.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.193 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.9 HD13 ' HB3' ' A' ' 441' ' ' ALA . 4.0 pp -74.45 -30.97 62.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -98.81 30.95 3.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.859 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.2 t -108.25 -16.01 14.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 5.6 m -66.53 127.34 27.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.864 0.364 . . . . 0.0 111.123 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -84.79 -41.73 15.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.9 p 55.89 -174.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.021 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -178.05 50.64 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.22 -28.92 4.21 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.454 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.757 ' HG2' HG23 ' A' ' 434' ' ' VAL . 0.3 OUTLIER -60.17 92.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.31 -35.61 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 20.5 p -61.81 -38.71 89.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.757 HG23 ' HG2' ' A' ' 431' ' ' GLN . 31.0 t -76.07 -36.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.056 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -40.99 94.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.88 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -69.22 -36.69 77.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 1.019 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.21 -45.1 58.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.417 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 439' ' ' LYS . 0.0 OUTLIER -65.17 -39.77 93.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.936 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 438' ' ' ARG . 0.0 OUTLIER -63.99 -43.42 95.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.601 179.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -32.31 71.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.696 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.9 ' HB3' HD13 ' A' ' 423' ' ' LEU . . . -66.9 -45.45 77.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.194 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.617 ' HA ' HD11 ' A' ' 445' ' ' ILE . 23.2 t -62.89 -30.78 50.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.111 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 4.0 t -67.35 -40.64 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.917 0.389 . . . . 0.0 110.48 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -44.73 78.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.087 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 1.044 HD12 HD12 ' A' ' 420' ' ' LEU . 9.4 pt -65.35 -31.23 52.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.916 0.388 . . . . 0.0 110.873 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.18 -47.78 84.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.725 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.67 80.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.819 HD12 ' HA ' ' A' ' 445' ' ' ILE . 21.4 mt -66.88 -36.6 77.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.718 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.45 -51.52 69.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.675 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -61.93 -30.47 70.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 110.336 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.39 75.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.075 0.464 . . . . 0.0 109.992 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.902 HD11 HG11 ' A' ' 397' ' ' VAL . 4.9 mp -70.81 -36.8 73.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.287 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -56.16 -29.84 61.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.187 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -101.19 -16.57 16.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.544 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -22.23 35.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.709 0.29 . . . . 0.0 110.95 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.36 -86.39 0.61 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.381 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.881 179.943 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.518 -0.259 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.9 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.8 mm -58.65 -29.76 40.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 2.1 mmpt? -56.71 -32.97 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.103 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -66.1 -41.98 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.941 0.401 . . . . 0.0 111.529 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.9 HG22 ' O ' ' A' ' 380' ' ' ILE . 7.8 tp -60.57 -31.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.547 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.693 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.91 -44.82 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.696 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -58.56 -49.35 77.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.809 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.452 HG13 ' N ' ' A' ' 387' ' ' LEU . 11.9 p -64.1 -42.89 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.452 ' N ' HG13 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -65.56 -33.5 76.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.681 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.87 -34.82 78.18 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.947 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.15 -43.38 87.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.487 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.71 HG13 ' OE2' ' A' ' 419' ' ' GLU . 28.0 t -61.97 -35.97 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.853 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.01 -41.07 97.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.808 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -68.27 -42.2 79.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.77 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.81 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.3 mm? -61.26 -38.22 85.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.717 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -60.38 -45.64 92.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.724 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -60.94 -35.68 77.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.808 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -69.34 -39.93 77.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.006 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 393' ' ' LEU . 9.0 t -60.62 -39.71 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.842 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -40.31 72.04 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.435 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -76.88 -54.27 6.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.101 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.689 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.5 t80 -24.3 113.11 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.051 -0.977 . . . . 0.0 113.222 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.616 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.5 p -104.71 28.11 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.351 178.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.689 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -50.58 -179.96 0.03 OUTLIER Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.87 -0.605 . . . . 0.0 113.411 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.88 143.51 48.33 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.708 -0.746 . . . . 0.0 111.636 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -20.46 43.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.493 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.2 m -101.87 -14.33 17.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.751 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.5 ' OD2' ' HB3' ' A' ' 408' ' ' ALA . 23.7 t70 -77.47 151.44 34.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.786 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.9 OUTLIER -71.29 -32.02 68.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 179.788 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.5 ' HB3' ' OD2' ' A' ' 406' ' ' ASP . . . -62.89 -29.1 70.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.342 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.529 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 29.8 t80 -64.23 -45.4 88.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.797 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.786 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.3 p-90 -72.82 -27.84 62.2 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 118.826 -1.149 . . . . 0.0 108.677 177.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.568 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.3 mp -67.59 -41.37 84.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.521 177.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 1.019 HD12 HD11 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.35 -47.21 86.91 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.285 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.545 ' HG2' HD23 ' A' ' 449' ' ' LEU . 11.3 mt-10 -70.49 -32.37 69.85 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.483 177.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.83 -43.42 96.25 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.721 -179.676 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.739 ' CE ' HD11 ' A' ' 393' ' ' LEU . 18.7 ttt -69.66 -41.37 75.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.266 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.626 ' O ' HD13 ' A' ' 416' ' ' LEU . 0.4 OUTLIER -66.04 -37.21 85.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.721 179.637 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.435 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 85.0 m -67.71 -30.31 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.91 -38.4 72.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.441 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.71 ' OE2' HG13 ' A' ' 390' ' ' VAL . 5.4 pt-20 -70.78 -37.95 73.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.556 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.854 HD12 ' N ' ' A' ' 421' ' ' LEU . 4.2 pp -72.97 -33.32 65.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 110.851 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.854 ' N ' HD12 ' A' ' 420' ' ' LEU . 1.1 tp -68.49 -32.24 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -71.1 -39.48 72.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.793 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.691 HD13 ' HB1' ' A' ' 441' ' ' ALA . 3.0 mt -58.56 -31.74 68.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.833 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.13 -25.04 17.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.082 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 38.3 t -55.44 -31.02 61.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.023 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 7.6 m -74.68 120.87 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.109 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -88.4 143.15 27.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.411 HG21 ' CG1' ' A' ' 434' ' ' VAL . 27.1 p -131.23 -170.51 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.883 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -147.86 -90.58 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.516 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -96.45 29.76 9.79 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 89.82 4.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -40.05 96.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.809 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.3 t -60.0 -41.03 91.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.827 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.411 ' CG1' HG21 ' A' ' 428' ' ' THR . 32.1 t -71.4 -35.61 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.978 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . 0.434 ' HA ' ' HD3' ' A' ' 438' ' ' ARG . 0.1 OUTLIER -64.5 -43.54 93.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.716 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . 0.402 ' HA ' ' HG2' ' A' ' 439' ' ' LYS . 2.8 tt0 -69.19 -32.85 72.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.871 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.33 -45.13 61.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.863 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.434 ' HD3' ' HA ' ' A' ' 435' ' ' ARG . 14.5 ptm180 -64.12 -44.55 91.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.572 0.225 . . . . 0.0 111.333 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . 0.436 ' HG3' ' N ' ' A' ' 440' ' ' GLU . 1.5 pttt -63.72 -32.87 74.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.903 0.382 . . . . 0.0 110.576 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 4.7 mm-40 -67.75 -31.24 71.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.533 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.691 ' HB1' HD13 ' A' ' 423' ' ' LEU . . . -70.59 -40.2 73.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.798 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.561 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 21.2 t -62.86 -34.13 64.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 66.0 m -70.7 -43.52 68.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.732 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.87 -44.75 69.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.009 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.776 HD13 HD22 ' A' ' 420' ' ' LEU . 2.3 pp -63.89 -31.13 51.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.107 0.48 . . . . 0.0 110.697 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -39.88 90.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.341 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.56 81.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.055 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.801 ' CG2' HG21 ' A' ' 397' ' ' VAL . 19.3 mt -72.67 -38.33 58.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.545 HD23 ' HG2' ' A' ' 413' ' ' GLU . 3.5 mt -57.76 -48.52 79.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -70.18 -37.17 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.638 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.89 -31.27 66.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.082 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 1.019 HD11 HD12 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -76.23 -36.74 58.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.444 179.351 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.74 -29.91 65.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.602 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.11 -13.46 28.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.248 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.415 ' CE ' HG12 ' A' ' 397' ' ' VAL . 0.0 OUTLIER -82.42 -24.24 34.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.809 0.338 . . . . 0.0 110.6 179.82 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -79.11 -80.61 0.75 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.368 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.255 -0.878 . . . . 0.0 110.862 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 N--CA 1.462 0.143 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.916 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.4 mm -58.85 -30.09 41.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.229 0.538 . . . . 0.0 109.691 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 20.2 pttt -56.66 -33.01 65.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.932 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.648 ' O ' HG23 ' A' ' 386' ' ' VAL . 32.4 mttt -65.07 -42.96 93.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.589 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.916 HG22 ' O ' ' A' ' 380' ' ' ILE . 0.8 OUTLIER -60.57 -32.04 50.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.717 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.88 -44.76 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.545 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -56.69 -47.31 80.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.692 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 382' ' ' LYS . 37.2 t -65.43 -34.5 70.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.669 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.44 82.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.49 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 0.6 OUTLIER -62.73 -34.64 77.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.581 178.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . 0.803 ' O ' HD23 ' A' ' 393' ' ' LEU . 0.0 OUTLIER -70.16 -34.67 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.438 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 386' ' ' VAL . 28.2 t -67.08 -46.76 83.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 13.5 pt20 -60.36 -40.93 92.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -68.52 -38.77 81.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.302 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.84 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.6 mm? -64.91 -37.9 89.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.323 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . 0.407 ' HB2' HD11 ' A' ' 448' ' ' ILE . 4.5 tt0 -58.86 -44.0 90.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.457 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.5 -39.64 88.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.694 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -69.24 -40.05 78.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.908 HG21 HG21 ' A' ' 448' ' ' ILE . 23.7 t -60.63 -36.98 74.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.68 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -38.31 70.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.203 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.501 ' O ' ' C ' ' A' ' 400' ' ' PHE . 18.2 tt0 -79.84 -55.46 4.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.043 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.648 ' CE1' HD23 ' A' ' 412' ' ' LEU . 20.4 t80 -4.71 109.12 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.404 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 23.3 m -101.47 25.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.692 178.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.602 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -67.36 -173.59 6.53 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.843 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.0 143.74 48.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.305 -0.447 . . . . 0.0 111.496 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.455 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -57.27 -24.3 53.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.903 179.147 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . 0.425 HG22 ' O ' ' A' ' 405' ' ' THR . 7.6 m -103.84 13.33 33.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.204 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.71 149.24 28.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.791 0.329 . . . . 0.0 110.687 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.782 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.16 -30.09 70.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.97 0.414 . . . . 0.0 110.9 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.78 -29.15 70.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.012 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 3.0 t80 -68.01 -45.56 73.68 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.782 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.13 63.84 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.691 177.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.577 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -66.44 -40.05 89.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.423 177.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -60.83 -47.25 87.21 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.544 ' HA ' HD21 ' A' ' 416' ' ' LEU . 0.9 OUTLIER -70.73 -32.27 69.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.729 177.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.85 -45.26 90.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.636 -179.165 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.502 ' HA ' ' HG2' ' A' ' 418' ' ' LYS . 21.4 ptp -66.45 -44.79 81.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.748 0.309 . . . . 0.0 111.136 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.676 HD12 ' N ' ' A' ' 417' ' ' THR . 4.1 pp -69.26 -37.13 77.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.831 0.348 . . . . 0.0 111.073 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.676 ' N ' HD12 ' A' ' 416' ' ' LEU . 98.5 m -73.61 -44.03 58.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.679 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -58.01 -37.96 75.25 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.599 -179.627 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.498 ' OE2' HG22 ' A' ' 390' ' ' VAL . 19.0 pt-20 -72.27 -34.8 68.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.206 0.527 . . . . 0.0 109.651 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.86 ' HA ' HD12 ' A' ' 423' ' ' LEU . 15.5 tp -65.98 -44.13 85.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.446 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.63 -34.07 75.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.78 -39.46 94.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.433 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.86 HD12 ' HA ' ' A' ' 420' ' ' LEU . 6.7 mt -60.21 -35.17 74.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.789 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.24 -28.85 57.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.061 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.3 m -57.01 -34.87 68.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.962 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.06 120.15 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.0 158.13 8.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.992 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.446 ' HA ' HG21 ' A' ' 434' ' ' VAL . 72.3 p -122.71 -72.69 0.67 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 71.9 -100.47 0.93 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.551 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -118.71 72.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.479 ' HB3' HG22 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -160.21 108.8 1.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.902 0.382 . . . . 0.0 110.823 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.57 -28.63 67.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.397 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.8 m -57.54 -44.97 85.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.685 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.479 HG22 ' HB3' ' A' ' 431' ' ' GLN . 17.2 m -76.11 -35.48 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.147 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -44.43 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.872 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -35.8 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.777 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.96 -32.13 65.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.99 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.537 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -72.72 -42.45 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.354 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 -36.64 84.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.567 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -42.57 99.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.81 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.523 ' CB ' HD13 ' A' ' 423' ' ' LEU . . . -62.07 -45.57 92.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.915 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.573 HG22 HD11 ' A' ' 420' ' ' LEU . 22.2 t -63.96 -31.64 54.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.909 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 97.9 m -70.7 -46.78 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.924 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -44.76 76.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.763 HG12 HD13 ' A' ' 420' ' ' LEU . 2.4 pp -64.14 -31.13 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.792 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -46.58 88.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.152 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -63.08 -36.03 82.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.684 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.908 HG21 HG21 ' A' ' 397' ' ' VAL . 17.6 mt -73.14 -36.54 50.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.806 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.49 -49.26 76.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.702 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -41.87 66.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.416 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.9 mmtp -57.88 -30.01 65.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.083 0.468 . . . . 0.0 110.007 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.462 HD12 HG13 ' A' ' 397' ' ' VAL . 1.8 tp -76.72 -36.72 56.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.438 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -56.98 -29.9 63.65 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -96.52 -11.16 25.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.477 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.56 -24.69 33.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -94.66 -71.34 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.416 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.401 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.935 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.518 -0.26 0 CA-C-O 120.697 0.284 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.654 HG22 HD11 ' A' ' 384' ' ' ILE . 3.2 mt -58.71 -29.77 40.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -56.8 -33.17 66.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.978 -179.815 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -67.48 -38.03 83.77 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.135 0.493 . . . . 0.0 110.745 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 40.8 mm -60.44 -33.58 54.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.63 178.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.654 HD11 HG22 ' A' ' 380' ' ' ILE . 0.4 OUTLIER -74.74 -44.41 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.411 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -56.57 -45.12 81.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 382' ' ' LYS . 57.8 t -66.13 -39.63 84.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.162 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.681 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.58 -32.57 73.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.292 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -35.14 79.18 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -38.06 74.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.184 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.681 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.9 p -70.38 -37.7 71.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.582 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -66.9 -40.97 87.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.841 0.353 . . . . 0.0 110.624 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -40.75 75.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.468 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.898 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.7 OUTLIER -62.04 -38.65 89.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.426 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -59.63 -47.32 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.676 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -36.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.659 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -69.32 -37.5 77.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.096 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 393' ' ' LEU . 25.6 t -60.53 -45.64 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.218 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -55.49 -31.92 62.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.915 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -87.4 -54.39 4.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.52 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.799 ' CE2' HD22 ' A' ' 412' ' ' LEU . 4.1 t80 -48.11 113.54 0.76 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.741 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.468 ' O ' ' O ' ' A' ' 402' ' ' GLY . 28.7 m -47.68 -31.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.881 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.689 ' HA2' ' CZ ' ' A' ' 400' ' ' PHE . . . 37.4 106.7 0.01 OUTLIER Glycine 0 C--O 1.228 -0.264 0 N-CA-C 114.679 0.632 . . . . 0.0 114.679 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.25 143.0 48.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.039 0.447 . . . . 0.0 110.893 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.487 ' HG2' ' CB ' ' A' ' 457' ' ' LEU . 0.2 OUTLIER -60.09 -22.18 62.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.217 179.764 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.99 1.1 51.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.35 135.64 53.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.917 0.389 . . . . 0.0 110.564 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.706 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 10.9 mtmt -61.01 -29.87 69.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.641 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 412' ' ' LEU . . . -62.71 -28.97 70.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.054 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 38.5 t80 -67.23 -45.85 75.55 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.706 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -73.05 -30.27 63.59 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 118.824 -1.15 . . . . 0.0 108.934 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.579 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.0 tp -69.63 -38.45 77.22 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.743 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 1.044 HD23 HD11 ' A' ' 452' ' ' LEU . 0.3 OUTLIER -62.31 -47.16 85.49 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -70.64 -32.81 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.408 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.1 mt-10 -64.1 -43.6 94.85 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.824 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 39.2 ttm -69.59 -35.26 75.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.659 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 11.3 tp -63.41 -48.08 79.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.818 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 52.7 m -65.01 -30.46 71.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.066 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -47.34 85.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.259 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.45 ' OE2' HG23 ' A' ' 390' ' ' VAL . 2.9 pt-20 -67.21 -36.16 81.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.577 HD13 ' C ' ' A' ' 420' ' ' LEU . 3.1 tm? -67.74 -34.64 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.001 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.22 -31.9 69.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -43.0 98.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.772 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 438' ' ' ARG . 0.2 OUTLIER -54.79 -31.15 58.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.014 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -76.64 -14.19 60.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 5.8 m -84.58 -25.79 28.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.768 0.318 . . . . 0.0 111.143 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.6 137.73 24.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.167 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.9 164.55 25.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.541 HG21 HH11 ' A' ' 438' ' ' ARG . 2.0 t -178.48 126.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.71 -84.97 1.78 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.439 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.89 38.09 1.86 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.473 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.559 ' HB3' HG22 ' A' ' 434' ' ' VAL . 0.5 OUTLIER -91.77 123.82 35.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 110.892 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -67.69 -28.65 67.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.076 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.6 t -67.17 -44.85 78.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.675 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.559 HG22 ' HB3' ' A' ' 431' ' ' GLN . 21.4 m -75.47 -37.59 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.733 0.301 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 40.1 mtt180 -67.66 -44.65 77.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.911 0.386 . . . . 0.0 110.697 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -69.41 -34.46 74.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.94 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.24 -45.22 57.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.513 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.541 HH11 HG21 ' A' ' 428' ' ' THR . 0.9 OUTLIER -65.06 -39.12 92.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.781 0.324 . . . . 0.0 110.884 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -35.21 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.529 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.38 -35.89 80.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.441 ' CB ' HD13 ' A' ' 423' ' ' LEU . . . -62.09 -45.43 93.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.548 HG22 HD21 ' A' ' 420' ' ' LEU . 24.3 t -62.96 -33.29 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.752 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.2 m -70.73 -45.23 65.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.506 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -44.65 77.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.062 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.618 HD12 ' N ' ' A' ' 446' ' ' GLN . 2.8 pp -63.37 -31.03 51.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.618 ' N ' HD12 ' A' ' 445' ' ' ILE . 5.6 tp-100 -65.1 -41.54 94.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.508 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.49 -40.2 92.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.401 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.6 mt -67.7 -36.66 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -46.99 83.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.698 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -40.58 68.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.536 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -30.6 66.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.025 0.44 . . . . 0.0 109.967 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 1.044 HD11 HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -77.59 -36.76 51.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.264 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.5 -29.94 69.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.629 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -86.64 -18.8 30.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.427 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 402' ' ' GLY . 0.0 OUTLIER -82.25 -25.93 33.65 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.828 ' O ' HD12 ' A' ' 457' ' ' LEU . . . -130.42 -115.96 1.8 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.828 HD12 ' O ' ' A' ' 456' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.03 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 66.0 m . . . . . 0 CA--C 1.52 -0.179 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.686 HG22 HD11 ' A' ' 384' ' ' ILE . 43.8 mm -58.63 -29.77 40.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.474 ' HA ' HG12 ' A' ' 384' ' ' ILE . 27.3 mtmm -56.92 -33.16 66.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.06 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -67.92 -37.97 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.133 0.492 . . . . 0.0 110.694 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.877 HG21 ' HB1' ' A' ' 437' ' ' ALA . 37.5 mt -60.55 -33.6 55.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.41 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.686 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.77 -44.65 45.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.237 178.477 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -49.38 77.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.669 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.724 HG21 ' HB3' ' A' ' 423' ' ' LEU . 14.5 p -65.47 -45.02 94.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.494 ' N ' HG13 ' A' ' 386' ' ' VAL . 5.3 tt -63.38 -33.41 75.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.8 -35.05 78.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.741 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.38 -40.26 93.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.286 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.86 HG22 ' OE2' ' A' ' 419' ' ' GLU . 24.6 t -64.35 -37.01 78.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 -41.15 89.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -63.42 -38.52 91.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.455 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.802 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -63.77 -38.03 89.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 179.544 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.93 -42.79 90.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.639 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.95 -40.3 92.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -69.12 -45.26 70.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.777 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 393' ' ' LEU . 23.1 t -60.65 -36.91 73.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.705 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -58.42 -40.36 82.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.101 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -84.16 -67.55 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.809 ' CD1' HD22 ' A' ' 412' ' ' LEU . 18.6 t80 21.96 107.83 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 401' ' ' VAL . 20.4 t -95.79 25.93 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.065 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.583 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -84.88 -176.8 50.95 Favored Glycine 0 N--CA 1.441 -0.99 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.732 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.25 143.81 48.02 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.404 -0.398 . . . . 0.0 111.628 -179.73 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.492 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -58.6 -23.52 58.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.82 0.343 . . . . 0.0 110.867 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . 0.414 HG22 ' HD2' ' A' ' 404' ' ' LYS . 16.1 p -101.99 12.96 36.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.104 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.64 153.5 26.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.8 0.334 . . . . 0.0 110.873 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.819 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.2 mttt -61.15 -30.1 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.899 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.73 -29.19 70.49 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.508 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.492 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 3.7 t80 -72.06 -45.67 59.86 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.819 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -73.07 -29.36 62.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 118.841 -1.144 . . . . 0.0 108.9 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 15.8 tp -69.68 -41.32 75.61 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.428 178.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.809 HD22 ' CD1' ' A' ' 400' ' ' PHE . 8.0 tp -61.07 -46.71 89.56 Favored 'General case' 0 C--N 1.34 0.168 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.454 ' HG2' HD11 ' A' ' 416' ' ' LEU . 1.1 tt0 -70.2 -32.16 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.602 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.5 OUTLIER -63.9 -37.78 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.83 -179.652 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 5.9 ttt -69.75 -44.57 69.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.173 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.847 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -68.88 -37.01 78.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.791 0.329 . . . . 0.0 110.843 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.847 ' N ' HD12 ' A' ' 416' ' ' LEU . 90.4 m -62.58 -33.57 75.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.493 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -66.35 -47.46 73.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.138 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.86 ' OE2' HG22 ' A' ' 390' ' ' VAL . 0.3 OUTLIER -69.77 -34.7 74.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.82 HD12 ' CG2' ' A' ' 445' ' ' ILE . 6.2 tt -59.6 -44.42 93.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.864 178.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' A' ' 421' ' ' LEU . 1.7 tp -70.51 -31.82 69.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.354 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.67 -46.88 87.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.427 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.777 HD21 HD11 ' A' ' 445' ' ' ILE . 1.7 pp -74.55 -31.06 61.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.797 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.78 -19.46 61.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.116 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 35.5 t -95.3 35.38 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.197 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . 0.449 HG13 ' O ' ' A' ' 423' ' ' LEU . 34.1 m -97.78 131.92 43.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -91.85 128.15 37.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.1 t -113.94 145.31 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.92 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.29 66.46 0.55 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.439 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.35 74.49 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.495 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.468 ' OE1' HG21 ' A' ' 434' ' ' VAL . 86.1 mt-30 -97.22 114.03 25.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 0.0 110.844 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.79 -31.58 72.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 18.5 t -63.48 -44.42 94.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.468 HG21 ' OE1' ' A' ' 431' ' ' GLN . 21.8 t -68.47 -38.94 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.116 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -44.61 96.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.884 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -69.23 -35.64 76.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.851 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 0.877 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.19 -37.02 66.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.181 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.73 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.3 OUTLIER -72.7 -44.69 61.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 -179.809 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -34.09 75.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.879 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.13 -41.76 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -63.75 -45.73 88.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.339 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 438' ' ' ARG . 34.0 t -63.82 -32.81 58.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.873 0.368 . . . . 0.0 110.854 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.88 -43.57 98.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.588 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.21 -37.78 88.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.82 ' CG2' HD12 ' A' ' 420' ' ' LEU . 14.7 mt -63.26 -33.21 59.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.106 0.479 . . . . 0.0 110.575 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.22 -47.72 83.19 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.752 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.58 70.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.862 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.788 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.6 mt -62.52 -37.07 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.643 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -52.93 63.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.647 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -39.53 86.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.525 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.4 ttpp -57.89 -30.12 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.209 0.528 . . . . 0.0 109.729 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' A' ' 400' ' ' PHE . 36.4 tp -72.82 -36.43 67.53 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.416 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.91 -29.9 60.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.221 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.36 -22.8 32.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.198 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.37 -21.89 35.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -69.07 -99.98 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.401 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.923 179.968 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 24.0 m . . . . . 0 CA--C 1.519 -0.225 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.735 ' HA ' HD12 ' A' ' 383' ' ' ILE . 31.3 mm -58.71 -29.87 40.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.461 ' HA ' HG12 ' A' ' 384' ' ' ILE . 15.2 mtmt -56.96 -33.26 66.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.82 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.455 ' O ' HG12 ' A' ' 386' ' ' VAL . 4.1 mttt -67.62 -38.02 83.33 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.128 0.489 . . . . 0.0 110.763 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.738 HG21 ' HB1' ' A' ' 437' ' ' ALA . 24.8 mt -60.48 -34.01 56.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.449 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.643 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.66 -44.78 46.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.204 178.445 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -48.53 81.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.468 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.497 HG13 ' N ' ' A' ' 387' ' ' LEU . 14.5 p -67.45 -45.88 84.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.497 ' N ' HG13 ' A' ' 386' ' ' VAL . 6.5 tt -64.59 -33.62 76.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.378 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -62.68 -35.06 78.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.704 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -39.18 91.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.1 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.867 HG13 ' OE2' ' A' ' 419' ' ' GLU . 40.5 t -66.81 -36.03 76.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.413 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -40.97 85.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.582 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -48.0 76.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.47 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.811 HD22 HD23 ' A' ' 416' ' ' LEU . 4.9 tt -60.88 -38.09 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.406 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -39.32 83.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.379 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -61.48 -40.51 94.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.427 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -68.11 -40.89 82.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.638 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.728 HG23 ' O ' ' A' ' 393' ' ' LEU . 22.0 t -60.67 -30.5 47.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.693 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -61.99 -36.82 82.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.188 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -87.48 -67.75 0.8 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.215 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.951 ' CD1' HD22 ' A' ' 412' ' ' LEU . 5.5 t80 56.13 159.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.423 0.63 . . . . 0.0 111.915 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 m -142.26 20.49 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.056 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.563 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -108.18 -172.68 21.7 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.799 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.442 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.08 144.53 48.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.718 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.554 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.77 -28.6 15.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.124 179.238 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.7 t -102.68 15.89 28.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -115.44 157.69 23.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.92 0.39 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.831 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.8 tmtt? -61.18 -30.09 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.963 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.85 -29.13 70.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.632 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.554 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 11.0 t80 -75.18 -45.9 37.64 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.831 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -73.1 -31.99 64.69 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.68 -1.208 . . . . 0.0 108.61 177.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.607 HD11 ' CE ' ' A' ' 415' ' ' MET . 38.7 tp -65.67 -41.11 92.84 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.093 177.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.956 HD23 HD21 ' A' ' 452' ' ' LEU . 30.4 tp -59.66 -46.73 88.14 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.18 -31.72 69.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.773 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.9 tm-20 -63.28 -43.39 98.04 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.983 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.607 ' CE ' HD11 ' A' ' 411' ' ' LEU . 9.7 mmt -67.06 -40.18 87.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 109.664 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.811 HD23 HD22 ' A' ' 393' ' ' LEU . 1.2 tm? -61.11 -37.36 82.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.645 179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 3.6 m -62.84 -42.18 99.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.884 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -47.22 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.844 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.867 ' OE2' HG13 ' A' ' 390' ' ' VAL . 3.9 pt-20 -70.85 -34.78 72.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.372 . . . . 0.0 110.125 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 1.042 HD11 HD13 ' A' ' 445' ' ' ILE . 1.2 tt -61.61 -45.1 95.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.122 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 421' ' ' LEU . 3.4 tp -70.21 -31.88 69.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.785 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -58.9 -46.29 88.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.837 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 419' ' ' GLU . 1.2 mt -59.54 -31.42 69.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.806 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -100.47 29.18 4.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.913 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 57.6 m -107.96 -29.22 9.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 15.0 m -66.54 133.5 31.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.08 166.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.498 ' HB ' HG11 ' A' ' 434' ' ' VAL . 1.8 t -156.67 -45.84 0.07 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.914 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 75.01 -69.28 1.9 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.444 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -164.5 40.71 0.3 Allowed Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.425 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -96.38 119.56 35.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -63.11 -31.45 72.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.859 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.7 m -67.65 -42.38 82.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.939 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.498 HG11 ' HB ' ' A' ' 428' ' ' THR . 26.2 t -73.44 -43.46 55.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 438' ' ' ARG . 4.7 mtt180 -59.21 -40.64 86.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.752 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -69.4 -34.58 74.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.892 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 0.738 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -71.77 -45.34 61.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.634 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 435' ' ' ARG . 0.2 OUTLIER -66.33 -35.06 79.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.389 . . . . 0.0 110.602 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -34.25 77.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -67.33 -37.0 82.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.76 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.478 ' HB1' HD13 ' A' ' 423' ' ' LEU . . . -61.95 -45.53 93.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.058 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.543 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 31.5 t -63.32 -32.76 57.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.788 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -46.79 62.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.023 0.44 . . . . 0.0 110.815 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.73 88.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.046 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 1.042 HD13 HD11 ' A' ' 420' ' ' LEU . 1.9 pp -63.37 -31.15 51.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.99 0.424 . . . . 0.0 110.609 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.32 -47.7 84.89 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.837 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.74 -35.85 79.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.466 HD12 ' HA ' ' A' ' 445' ' ' ILE . 41.6 mt -70.16 -36.4 67.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.861 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -48.33 79.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.72 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -39.71 91.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.24 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -57.77 -30.1 65.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.166 0.508 . . . . 0.0 109.692 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.956 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -72.08 -37.28 69.64 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.378 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -58.07 -29.91 65.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.63 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . 0.402 ' O ' HD13 ' A' ' 457' ' ' LEU . 7.8 mtmt -91.01 -15.07 30.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.485 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -24.41 34.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.884 0.373 . . . . 0.0 110.583 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.32 -86.58 0.35 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.262 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 454' ' ' LYS . 3.8 mp . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.774 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.465 0.32 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.59 HG22 HD11 ' A' ' 384' ' ' ILE . 24.8 mm -58.62 -29.38 39.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.458 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.55 -33.31 66.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.008 -179.715 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -68.24 -38.09 81.48 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.224 0.535 . . . . 0.0 110.65 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.748 HD11 HG13 ' A' ' 434' ' ' VAL . 47.7 mt -60.49 -33.97 56.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.531 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.59 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.78 -44.63 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.348 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -56.8 -48.44 77.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.323 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.749 HG21 ' HG ' ' A' ' 423' ' ' LEU . 13.5 p -66.41 -36.3 77.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.652 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.34 -35.93 80.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.43 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.79 -34.95 78.33 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -34.65 72.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.54 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 386' ' ' VAL . 21.4 t -70.4 -46.17 71.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.283 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -58.32 -38.8 77.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.683 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.78 -43.42 98.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.895 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -59.78 -38.55 82.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.47 179.531 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . 0.426 ' HG3' HD11 ' A' ' 448' ' ' ILE . 0.2 OUTLIER -59.01 -39.88 83.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.602 179.751 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -45.39 92.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.637 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -69.29 -44.26 72.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.76 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 393' ' ' LEU . 28.0 t -60.61 -31.38 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.507 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -60.38 -36.37 77.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.206 0.527 . . . . 0.0 109.928 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.48 ' O ' ' O ' ' A' ' 400' ' ' PHE . 5.2 tt0 -90.73 -69.03 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.926 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.776 ' CD1' HD22 ' A' ' 412' ' ' LEU . 10.2 t80 36.47 109.0 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.118 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 27.8 m -94.81 25.44 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.107 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.528 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.07 -174.46 43.83 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.707 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.81 143.61 48.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.574 -0.313 . . . . 0.0 111.413 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.531 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -56.69 -23.71 44.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.549 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.68 10.15 36.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.308 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.47 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 0.1 OUTLIER -101.93 150.58 23.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.841 0.353 . . . . 0.0 110.474 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.794 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 pptp? -61.13 -30.2 70.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.85 -29.23 70.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.24 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.531 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.6 t80 -69.69 -45.6 67.91 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.794 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 5.5 p-90 -72.87 -30.53 64.05 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.902 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.608 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 26.0 tp -69.69 -38.43 77.01 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.418 177.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.776 HD22 ' CD1' ' A' ' 400' ' ' PHE . 9.7 tp -61.53 -47.19 86.72 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.662 ' HG3' HD13 ' A' ' 452' ' ' LEU . 2.0 mt-10 -70.5 -32.52 70.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.483 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.608 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mm-40 -65.51 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.001 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.67 -44.49 70.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.025 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.769 HD12 ' N ' ' A' ' 417' ' ' THR . 4.3 pp -68.86 -37.05 78.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.782 0.325 . . . . 0.0 110.734 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.769 ' N ' HD12 ' A' ' 416' ' ' LEU . 59.7 m -64.15 -38.97 92.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.621 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -47.28 86.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.459 ' CD ' HD12 ' A' ' 393' ' ' LEU . 14.8 pt-20 -68.53 -34.75 76.42 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.929 ' HB2' HD13 ' A' ' 445' ' ' ILE . 0.3 OUTLIER -60.79 -40.88 94.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.048 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.405 ' HA ' HD12 ' A' ' 421' ' ' LEU . 3.3 tp -69.4 -31.83 70.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.824 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.54 -38.32 87.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.749 ' HG ' HG21 ' A' ' 386' ' ' VAL . 0.3 OUTLIER -58.82 -31.23 68.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.792 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.83 27.8 5.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.5 t -100.11 -29.75 12.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 4.3 m -93.77 123.79 46.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 154.58 22.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.985 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 88.4 m -111.19 -64.39 1.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 108.89 -121.9 6.37 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.442 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -106.01 36.14 4.59 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.395 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -106.9 100.19 9.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.835 0.35 . . . . 0.0 110.921 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.14 -33.93 76.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 4.1 t -60.99 -44.83 96.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.748 HG13 HD11 ' A' ' 383' ' ' ILE . 28.9 t -70.31 -42.45 78.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.152 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -59.62 -40.69 88.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.827 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.31 -41.78 98.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.05 89.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.978 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.81 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -66.67 -44.51 81.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.759 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -67.95 -39.73 83.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.682 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -71.19 -36.57 71.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.781 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.73 -45.54 82.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.001 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.916 ' HA ' HD12 ' A' ' 445' ' ' ILE . 38.6 t -64.58 -33.05 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.024 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 9.4 m -60.89 -43.98 97.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.17 -36.31 83.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.332 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.929 HD13 ' HB2' ' A' ' 420' ' ' LEU . 30.0 mt -63.93 -31.23 52.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -42.54 83.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.145 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.83 78.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.726 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.544 ' CG2' HG21 ' A' ' 397' ' ' VAL . 45.2 mt -65.07 -36.46 77.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.712 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -54.3 48.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.867 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -42.12 88.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.393 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -29.96 65.37 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.762 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -68.73 -38.24 80.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.289 179.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.77 -29.85 65.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.896 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.92 -23.57 25.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.221 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -20.06 37.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.775 0.321 . . . . 0.0 110.734 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -67.85 -86.73 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.026 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.489 HD23 ' HG2' ' A' ' 404' ' ' LYS . 1.1 pp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.894 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 120.588 0.232 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.626 HG22 HD11 ' A' ' 384' ' ' ILE . 42.5 mm -58.72 -29.66 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 16.9 mttt -56.74 -33.12 66.24 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.599 ' O ' HG23 ' A' ' 386' ' ' VAL . 24.3 mtmt -66.41 -38.04 86.56 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.204 0.526 . . . . 0.0 110.694 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 54.5 mt -60.5 -34.76 59.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.398 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.626 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.96 -44.58 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.224 178.392 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -56.65 -37.39 70.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.398 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 382' ' ' LYS . 68.5 t -73.52 -40.69 55.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.484 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.637 ' O ' HG12 ' A' ' 390' ' ' VAL . 1.2 tt -67.57 -37.54 82.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.327 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.94 -34.93 78.51 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -44.48 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.083 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.5 p -63.18 -41.19 91.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.426 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.4 ' HG3' ' N ' ' A' ' 392' ' ' TYR . 11.9 pt20 -63.28 -37.95 89.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.991 0.424 . . . . 0.0 110.433 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . 0.4 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 1.8 m-85 -72.47 -39.83 67.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.427 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.797 HD11 ' HG2' ' A' ' 415' ' ' MET . 0.3 OUTLIER -62.11 -42.48 99.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.89 92.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.713 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -62.21 -35.37 78.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.662 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.28 -42.43 75.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.826 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.784 HG23 ' O ' ' A' ' 393' ' ' LEU . 14.5 t -60.66 -32.45 51.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.666 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -61.2 -36.16 79.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.96 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.503 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.9 tt0 -91.78 -68.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.993 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.858 ' CE1' HD13 ' A' ' 412' ' ' LEU . 6.6 t80 45.02 -84.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.714 -0.675 . . . . 0.0 112.611 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 399' ' ' GLU . 5.7 t 78.35 28.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.508 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -98.57 -150.76 26.35 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.501 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.624 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.44 171.09 14.54 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 120.439 0.162 . . . . 0.0 110.598 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.46 ' HD2' HG23 ' A' ' 405' ' ' THR . 0.0 OUTLIER -91.0 -10.17 43.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.58 0.228 . . . . 0.0 111.155 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . 0.46 HG23 ' HD2' ' A' ' 404' ' ' LYS . 30.8 p -115.73 -15.55 11.32 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.498 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 18.2 t70 -61.54 162.37 8.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.887 0.375 . . . . 0.0 111.341 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.736 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.36 -38.42 71.57 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.627 179.671 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.418 ' HA ' ' HB2' ' A' ' 411' ' ' LEU . . . -62.69 -29.02 70.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.655 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.624 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 60.4 t80 -57.5 -45.4 84.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.926 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.736 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.58 -29.44 63.53 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 118.865 -1.134 . . . . 0.0 108.663 178.15 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -65.16 -39.34 92.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.356 177.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.858 HD13 ' CE1' ' A' ' 400' ' ' PHE . 8.3 tp -61.42 -47.04 87.58 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 30.6 tt0 -70.49 -32.27 69.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.688 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.563 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -64.02 -39.8 94.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.137 -179.426 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.797 ' HG2' HD11 ' A' ' 393' ' ' LEU . 41.2 ttm -69.74 -44.68 69.77 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.292 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 417' ' ' THR . 4.0 pp -68.75 -38.54 80.18 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.766 0.317 . . . . 0.0 110.683 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.78 ' N ' HD12 ' A' ' 416' ' ' LEU . 84.8 m -64.32 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.194 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . 0.631 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -66.01 -42.36 89.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.294 179.509 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.59 -36.65 68.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.318 0.58 . . . . 0.0 110.038 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.839 ' HG ' HG13 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -67.77 -49.26 63.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.833 -179.361 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.982 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -69.74 -31.53 69.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.138 -0.225 . . . . 0.0 111.355 -178.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . 0.982 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -61.09 -46.55 90.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.842 0.353 . . . . 0.0 110.791 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.805 HD22 ' HA ' ' A' ' 438' ' ' ARG . 4.2 mt -69.8 -31.0 68.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.061 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -82.41 0.5 41.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.414 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.11 -42.64 8.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 110.945 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.4 t -66.97 136.21 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.216 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -112.6 -178.45 3.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -138.68 160.92 38.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.854 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -126.96 43.34 1.35 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.481 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 136.77 -28.45 2.85 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.495 ' HB3' HG23 ' A' ' 434' ' ' VAL . 72.8 mt-30 -76.95 96.36 4.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.881 0.372 . . . . 0.0 110.905 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.21 -30.06 69.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.982 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -42.93 89.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.962 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.495 HG23 ' HB3' ' A' ' 431' ' ' GLN . 31.2 t -62.78 -35.63 71.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -65.54 -43.81 88.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.12 -32.88 72.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.144 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -68.61 -45.17 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.417 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.806 ' O ' HG23 ' A' ' 442' ' ' VAL . 11.1 ptt85 -72.63 -44.53 61.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.127 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -63.01 -34.61 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.836 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.12 -39.71 65.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.79 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.787 ' HB3' HD13 ' A' ' 423' ' ' LEU . . . -71.01 -45.57 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.1 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.839 HG13 ' HG ' ' A' ' 420' ' ' LEU . 46.9 t -62.86 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.959 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 11.8 t -60.9 -35.55 76.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.68 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.55 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.823 HD12 ' CA ' ' A' ' 420' ' ' LEU . 1.1 mt -65.52 -31.24 52.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -43.95 97.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.127 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.41 86.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.608 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.745 ' CG2' HG21 ' A' ' 397' ' ' VAL . 43.9 mt -67.43 -36.39 76.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.842 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.3 tt -57.35 -47.48 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.888 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -41.35 98.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.804 0.335 . . . . 0.0 110.125 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -30.13 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.778 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -67.15 -38.42 85.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.378 179.044 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.37 -29.89 62.01 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -89.7 -20.08 24.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.402 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -20.29 36.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.006 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.43 -81.55 0.45 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.469 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.955 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.748 HG22 HD11 ' A' ' 384' ' ' ILE . 1.6 mp -58.74 -28.82 38.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.514 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -55.78 -33.11 64.06 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.973 -179.055 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.646 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -66.98 -37.99 85.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.211 0.529 . . . . 0.0 110.617 179.586 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.922 HG21 ' HB1' ' A' ' 437' ' ' ALA . 39.4 mm -60.54 -34.42 58.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.577 178.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.748 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.78 -44.39 45.84 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.608 178.62 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -56.42 -42.55 78.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.836 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.684 ' O ' HG23 ' A' ' 390' ' ' VAL . 38.4 t -70.85 -36.65 65.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.914 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.402 HD21 ' NZ ' ' A' ' 444' ' ' LYS . 0.2 OUTLIER -67.66 -36.05 80.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.157 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -35.1 78.69 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -34.61 73.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.81 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.703 HG22 ' HB3' ' A' ' 419' ' ' GLU . 25.7 t -74.85 -35.82 37.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.312 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.37 -41.01 83.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.581 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.28 -41.81 76.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.05 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.761 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -65.39 -37.94 88.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.328 179.384 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -60.9 -41.15 95.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -39.79 88.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.37 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -68.76 -39.17 80.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.524 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 393' ' ' LEU . 35.2 t -60.71 -34.46 58.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.605 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -59.02 -40.24 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.989 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.8 tt0 -86.7 -68.23 0.76 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.823 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.868 ' CE1' HD13 ' A' ' 412' ' ' LEU . 4.7 t80 52.42 -80.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.454 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 401' ' ' VAL . 17.3 t 74.32 29.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.32 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -101.86 -151.38 24.17 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.654 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.64 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.4 OUTLIER -133.46 171.13 14.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.559 0.219 . . . . 0.0 110.732 -179.853 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.487 ' HA ' ' CD1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -91.98 -8.89 44.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.072 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.81 -14.58 11.34 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.484 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 33.8 t70 -63.62 163.05 11.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.913 0.387 . . . . 0.0 111.405 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.743 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.2 OUTLIER -71.52 -38.09 71.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.349 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.69 -28.94 70.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.622 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.64 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 58.4 t80 -58.26 -45.51 87.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.051 -179.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.743 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.64 -30.75 64.57 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 118.92 -1.112 . . . . 0.0 108.658 178.165 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 8.6 tp -64.73 -39.54 93.81 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.135 177.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.868 HD13 ' CE1' ' A' ' 400' ' ' PHE . 7.0 tp -60.48 -46.96 88.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -70.35 -32.2 69.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.9 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.6 -43.25 97.46 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.955 -179.249 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -69.44 -34.9 75.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.279 0.561 . . . . 0.0 110.1 179.143 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.761 HD11 ' HB ' ' A' ' 445' ' ' ILE . 1.8 tm? -60.42 -40.81 92.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.04 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.738 HG22 HD13 ' A' ' 421' ' ' LEU . 1.8 m -71.71 -32.46 67.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.006 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -47.11 84.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.539 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.703 ' HB3' HG22 ' A' ' 390' ' ' VAL . 8.8 mm-40 -63.58 -43.03 98.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.121 0.486 . . . . 0.0 109.703 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.637 HD11 HG22 ' A' ' 442' ' ' VAL . 2.8 tp -62.06 -43.59 98.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.14 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.738 HD13 HG22 ' A' ' 417' ' ' THR . 4.9 mp -61.78 -31.85 72.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.95 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -71.06 -37.14 72.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.741 HD22 ' CB ' ' A' ' 441' ' ' ALA . 0.5 OUTLIER -67.79 -31.02 70.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.925 179.915 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.16 -8.17 55.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.54 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.8 t -53.44 -30.13 38.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.802 0.334 . . . . 0.0 111.169 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . 0.579 HG11 HD11 ' A' ' 383' ' ' ILE . 12.1 m -70.79 131.18 34.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -85.58 -30.27 23.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.959 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.706 HG23 ' HB ' ' A' ' 434' ' ' VAL . 16.6 m 61.69 157.62 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.831 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -143.73 60.6 0.52 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.575 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 70.39 28.99 70.47 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.462 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -106.43 117.7 34.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.869 0.366 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.33 -31.44 70.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.85 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.0 t -60.31 -44.8 95.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.842 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.706 ' HB ' HG23 ' A' ' 428' ' ' THR . 26.5 t -75.44 -40.88 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -61.66 -40.99 96.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -34.82 75.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 0.922 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -67.25 -45.03 77.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.202 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 442' ' ' VAL . 7.2 ptm180 -71.15 -41.12 70.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.933 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 13.4 ttpt -62.2 -31.53 72.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.762 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -72.24 -37.6 69.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.731 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.741 ' CB ' HD22 ' A' ' 423' ' ' LEU . . . -66.64 -45.58 78.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.096 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.637 HG22 HD11 ' A' ' 420' ' ' LEU . 20.1 t -71.73 -30.74 39.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 46.8 t -70.71 -46.72 62.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.977 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . 0.402 ' NZ ' HD21 ' A' ' 387' ' ' LEU . 0.3 OUTLIER -68.11 -44.72 75.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.028 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.761 ' HB ' HD11 ' A' ' 416' ' ' LEU . 2.7 pp -63.35 -31.12 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.462 . . . . 0.0 110.771 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.465 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -63.41 -45.76 89.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.271 179.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.89 -34.19 74.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.536 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 445' ' ' ILE . 17.1 mt -74.75 -36.48 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.723 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 449' ' ' LEU . 0.2 OUTLIER -57.51 -53.87 53.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.861 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -61.46 -44.08 97.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.823 0.344 . . . . 0.0 110.342 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -29.75 65.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.753 HD21 HD23 ' A' ' 412' ' ' LEU . 0.5 OUTLIER -71.88 -40.04 69.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.803 179.479 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 454' ' ' LYS . 0.0 OUTLIER -64.28 -29.84 70.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.786 0.327 . . . . 0.0 110.841 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . 0.438 ' N ' ' HG3' ' A' ' 453' ' ' GLU . 0.3 OUTLIER -91.6 -13.96 31.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.301 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -82.51 -25.7 33.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.976 0.417 . . . . 0.0 110.465 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -72.66 -64.05 2.7 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.263 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.163 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 382' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.162 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.781 ' HA ' HD12 ' A' ' 383' ' ' ILE . 1.1 mm -58.74 -29.55 40.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.474 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.57 -33.22 65.95 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.631 -179.344 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.522 ' HG3' ' N ' ' A' ' 383' ' ' ILE . 0.1 OUTLIER -68.35 -37.63 80.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.077 0.465 . . . . 0.0 110.732 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 380' ' ' ILE . 16.2 mt -60.97 -34.06 58.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.482 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.474 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.97 -44.64 44.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.225 178.526 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -56.49 -47.57 78.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.334 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.582 ' O ' HG23 ' A' ' 390' ' ' VAL . 11.2 p -66.46 -37.38 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.189 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.57 -34.24 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.142 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 12.1 mt-10 -62.74 -34.83 78.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.57 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -70.27 -34.7 73.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.451 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' ' 386' ' ' VAL . 21.5 t -69.87 -46.35 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.353 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 394' ' ' GLU . 14.5 pt20 -58.46 -37.49 75.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.696 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . 0.408 ' O ' ' CG ' ' A' ' 395' ' ' GLN . 19.1 t80 -72.34 -35.1 68.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.205 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.674 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -70.35 -37.84 74.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.728 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 391' ' ' GLN . 0.0 OUTLIER -64.87 -38.88 92.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . 0.42 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 12.0 pt20 -69.77 -31.65 69.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.849 0.357 . . . . 0.0 110.467 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -68.73 -39.37 80.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.653 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.731 HG13 ' CD2' ' A' ' 412' ' ' LEU . 42.6 t -60.74 -47.29 93.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.593 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -56.69 -38.69 72.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.462 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -74.28 -58.09 3.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.38 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.838 ' CE1' HD22 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -56.86 125.15 21.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.367 0.603 . . . . 0.0 110.456 179.729 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.571 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.7 p -116.53 43.9 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.512 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.576 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.8 -164.3 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.841 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.452 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.83 143.79 48.57 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.789 0.328 . . . . 0.0 111.632 -179.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.494 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 7.9 mttt -61.53 -21.13 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.941 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 405' ' ' THR . 23.7 m -94.22 8.67 40.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.85 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.452 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t70 -115.07 161.78 17.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.976 0.417 . . . . 0.0 111.027 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.736 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.59 -30.0 65.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.3 179.438 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.62 ' HB1' ' HE2' ' A' ' 400' ' ' PHE . . . -62.81 -29.41 70.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.1 -179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.494 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 6.1 t80 -73.72 -46.13 47.89 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.296 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.736 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.3 p-90 -73.08 -29.01 62.64 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 118.853 -1.139 . . . . 0.0 108.78 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.613 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.6 tp -67.35 -39.81 85.77 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.886 177.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.838 HD22 ' CE1' ' A' ' 400' ' ' PHE . 2.6 tp -59.67 -46.91 87.63 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 1.6 tt0 -69.85 -31.68 69.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.421 177.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.613 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 2.4 mm-40 -63.48 -38.67 92.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.271 -179.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 1.9 mmt -69.72 -44.64 69.89 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.749 0.309 . . . . 0.0 111.004 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.875 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.0 -37.17 78.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.578 -179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.875 ' N ' HD12 ' A' ' 416' ' ' LEU . 1.0 OUTLIER -68.38 -43.75 76.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.733 0.302 . . . . 0.0 111.152 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -57.98 -47.22 83.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.382 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.451 ' OE2' HD13 ' A' ' 393' ' ' LEU . 13.6 pt-20 -65.9 -34.94 79.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.598 ' HB2' HG21 ' A' ' 445' ' ' ILE . 0.2 OUTLIER -67.05 -39.05 86.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.1 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.32 -31.8 69.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.918 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.01 -44.42 76.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.921 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.01 -35.86 77.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.878 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -79.35 -20.89 46.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 16.7 t -54.02 -30.91 49.53 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.89 0.376 . . . . 0.0 111.036 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.7 t -79.65 116.08 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.961 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.23 -34.01 61.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.447 HG22 ' HB2' ' A' ' 431' ' ' GLN . 0.2 OUTLIER 66.32 131.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.127 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.98 -89.2 1.79 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.372 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -107.86 64.63 0.26 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.335 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.497 ' HB3' HG23 ' A' ' 434' ' ' VAL . 49.4 mm-40 -139.56 87.5 2.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.851 0.358 . . . . 0.0 110.899 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -40.95 95.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.975 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 2.9 t -59.11 -43.28 91.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.011 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 431' ' ' GLN . 34.3 t -69.11 -35.53 68.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -44.47 78.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -69.31 -33.0 72.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.998 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.51 -44.73 67.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.433 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.897 ' O ' HG23 ' A' ' 442' ' ' VAL . 6.4 ptm180 -69.52 -40.66 76.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.214 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -44.9 82.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.891 0.377 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -69.82 -39.44 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.524 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.136 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 438' ' ' ARG . 41.0 t -62.94 -45.6 98.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.072 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . 0.599 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.6 m -60.38 -30.35 69.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.725 0.297 . . . . 0.0 110.213 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . 0.42 ' O ' HG13 ' A' ' 448' ' ' ILE . 37.9 tttp -63.94 -43.14 96.73 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.893 ' HA ' HD12 ' A' ' 448' ' ' ILE . 0.9 OUTLIER -73.62 -34.85 42.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.935 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.599 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.3 OUTLIER -60.7 -48.02 83.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.709 178.871 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -55.85 -42.7 76.21 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.72 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 445' ' ' ILE . 11.3 mt -64.52 -36.33 77.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.837 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.13 -44.66 83.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.894 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 -44.07 64.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 0.0 110.193 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 31.1 mtmm -57.86 -29.94 65.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.17 0.509 . . . . 0.0 109.666 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.759 HD11 HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -73.73 -36.71 65.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.441 179.304 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -29.98 67.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -93.68 -19.34 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm -82.55 -20.81 35.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.735 0.303 . . . . 0.0 110.919 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.42 ' HA3' ' CD2' ' A' ' 409' ' ' TYR . . . -82.12 -101.37 0.43 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.43 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.278 -0.868 . . . . 0.0 110.945 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.519 -0.236 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.73 HG22 HD11 ' A' ' 384' ' ' ILE . 31.2 mm -58.65 -29.75 40.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.486 ' HA ' HG12 ' A' ' 384' ' ' ILE . 11.5 mttt -56.77 -33.17 66.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.047 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.603 ' O ' HG23 ' A' ' 386' ' ' VAL . 4.2 pttm -68.27 -38.0 81.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.164 0.507 . . . . 0.0 110.517 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.571 HG21 ' HB1' ' A' ' 437' ' ' ALA . 43.6 mm -60.5 -33.37 54.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.521 178.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.73 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.84 -44.73 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.209 178.495 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -57.0 -49.38 75.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.48 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 382' ' ' LYS . 40.9 t -64.15 -36.13 75.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.41 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.596 HD23 ' O ' ' A' ' 387' ' ' LEU . 6.0 tt -67.46 -34.54 77.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.375 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . 0.442 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.0 tt0 -62.77 -35.0 78.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.622 179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -70.41 -34.57 72.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.728 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.679 HG22 ' OE2' ' A' ' 419' ' ' GLU . 25.8 t -65.35 -46.91 89.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 4.6 pt20 -63.15 -37.76 88.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.84 0.352 . . . . 0.0 110.708 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.22 -36.87 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.09 179.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.924 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.5 mt -65.91 -37.77 86.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.296 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . 0.409 ' HG3' ' CD1' ' A' ' 448' ' ' ILE . 2.6 mt-10 -58.7 -44.53 90.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.561 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -41.35 89.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.461 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -69.2 -39.92 78.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.013 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 393' ' ' LEU . 25.2 t -60.62 -30.66 47.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.803 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -66.83 -33.13 74.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.415 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' A' ' 400' ' ' PHE . 16.5 tt0 -89.43 -55.41 3.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.533 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.962 ' CD2' HD22 ' A' ' 412' ' ' LEU . 13.8 t80 -20.35 120.27 0.03 OUTLIER 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 401' ' ' VAL . 11.6 p -100.5 29.43 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.625 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.563 ' HA3' ' CE2' ' A' ' 400' ' ' PHE . . . -41.9 162.8 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.527 -0.761 . . . . 0.0 113.777 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.543 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 1.4 mppt? -133.56 143.67 48.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.151 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -17.46 53.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.703 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.4 m -108.4 -15.54 14.43 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.547 ' OD1' ' HB3' ' A' ' 408' ' ' ALA . 14.2 t70 -76.24 135.25 39.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.925 0.393 . . . . 0.0 110.743 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.741 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 mptp? -61.13 -30.82 70.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.214 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.547 ' HB3' ' OD1' ' A' ' 406' ' ' ASP . . . -65.41 -29.13 69.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.409 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 0.2 OUTLIER -68.95 -45.59 70.34 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.539 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.741 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 15.7 p-90 -72.86 -30.13 63.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.069 -1.053 . . . . 0.0 108.886 178.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 25.9 tp -69.76 -38.56 76.81 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.327 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.973 HD23 HD11 ' A' ' 452' ' ' LEU . 0.4 OUTLIER -62.09 -47.26 85.42 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.147 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.823 ' HA ' HD12 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.58 -32.28 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.302 177.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.77 -36.42 83.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.532 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.617 ' CE ' HD21 ' A' ' 393' ' ' LEU . 10.9 ttt -69.57 -41.05 76.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.004 0.431 . . . . 0.0 110.171 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.823 HD12 ' HA ' ' A' ' 413' ' ' GLU . 3.9 mt -62.43 -46.92 86.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.639 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.531 HG22 HD13 ' A' ' 421' ' ' LEU . 7.6 m -65.8 -30.44 71.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.767 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -47.31 86.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.159 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.679 ' OE2' HG22 ' A' ' 390' ' ' VAL . 8.5 pt-20 -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.584 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.78 HD21 HG22 ' A' ' 442' ' ' VAL . 3.4 tm? -68.49 -38.85 81.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.472 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.531 HD13 HG22 ' A' ' 417' ' ' THR . 1.3 mp -66.56 -31.98 73.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.668 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -45.07 86.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.748 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.533 HD11 HG11 ' A' ' 386' ' ' VAL . 5.5 mt -57.69 -32.57 67.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -79.88 -31.84 40.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 10.0 t -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . 0.44 HG11 ' HE3' ' A' ' 382' ' ' LYS . 21.5 t -80.56 119.64 30.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.078 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -70.39 131.66 44.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.933 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.402 ' CG2' HG11 ' A' ' 434' ' ' VAL . 19.0 p -108.48 -36.91 6.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.888 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 90.39 -91.96 1.73 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.488 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -152.54 47.78 0.55 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.5 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.443 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.1 OUTLIER -93.01 115.64 28.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 0.0 110.797 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -42.97 80.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 25.6 t -64.2 -44.86 90.66 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.923 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.443 HG23 ' HB3' ' A' ' 431' ' ' GLN . 37.8 t -69.55 -40.76 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -44.35 91.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.926 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -38.35 78.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 0.571 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -66.64 -45.13 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.273 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.707 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.2 ptm180 -68.11 -39.37 82.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.956 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -66.25 -34.44 78.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -71.39 -39.34 71.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.88 97.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.158 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.78 HG22 HD21 ' A' ' 420' ' ' LEU . 31.5 t -62.85 -39.64 85.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.996 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -36.63 79.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.492 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -34.69 78.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.572 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 442' ' ' VAL . 3.1 mm -66.78 -31.19 52.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.14 0.495 . . . . 0.0 110.751 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -45.99 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.663 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.47 -38.46 87.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.039 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.771 ' CG2' HG21 ' A' ' 397' ' ' VAL . 16.3 mt -74.83 -36.57 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.51 -43.56 84.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.938 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.77 62.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.629 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -57.84 -32.67 67.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 109.808 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.973 HD11 HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -77.64 -36.6 51.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.402 179.145 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.17 -30.0 61.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.553 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -91.95 -12.4 33.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.176 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -82.16 -26.4 33.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.125 0.488 . . . . 0.0 110.828 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -82.97 -96.32 0.55 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.375 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.008 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 81.3 p . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 120.694 0.283 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.629 HG22 HD11 ' A' ' 384' ' ' ILE . 28.9 mm -58.6 -29.65 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -33.2 66.35 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.849 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -67.25 -38.02 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.091 0.472 . . . . 0.0 110.836 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 380' ' ' ILE . 34.3 mt -60.52 -34.54 58.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.376 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.629 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.94 -44.67 44.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.318 178.444 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -57.02 -49.35 76.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.411 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.52 -37.78 80.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.483 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.627 ' O ' HG12 ' A' ' 390' ' ' VAL . 4.3 tt -67.57 -32.96 74.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.82 -35.21 79.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.48 66.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.147 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.4 p -63.5 -39.09 84.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.479 -179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.16 -34.52 77.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.901 0.381 . . . . 0.0 110.627 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.99 -43.46 95.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.579 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.65 HD13 ' OE1' ' A' ' 419' ' ' GLU . 0.2 OUTLIER -60.55 -37.91 82.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.596 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -58.79 -44.05 90.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.485 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.62 -31.65 72.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.509 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -68.42 -44.17 75.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.837 HG22 HD11 ' A' ' 412' ' ' LEU . 19.7 t -60.68 -38.05 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.821 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -59.49 -32.58 70.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.522 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 401' ' ' VAL . 9.6 tt0 -78.63 -57.35 3.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.555 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.662 ' CG ' HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -60.34 127.7 33.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.288 0.566 . . . . 0.0 110.53 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.575 ' O ' HG12 ' A' ' 401' ' ' VAL . 22.1 t -123.11 39.86 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.401 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.545 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -53.76 -166.13 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.678 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.518 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.96 149.19 51.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 0.0 111.853 -179.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.493 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 2.0 mmmt -58.78 -25.09 62.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.081 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 70.9 p -85.94 3.7 40.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.448 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.518 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 26.4 t70 -111.96 156.68 21.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.111 0.482 . . . . 0.0 111.432 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.759 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.4 mttp -69.31 -29.97 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.039 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.516 ' HB1' ' HE2' ' A' ' 400' ' ' PHE . . . -62.87 -29.42 70.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.328 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.493 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 33.1 t80 -69.2 -45.53 69.65 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.969 -179.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.759 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.3 OUTLIER -72.63 -32.66 66.07 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 118.628 -1.229 . . . . 0.0 108.539 178.162 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.588 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 17.8 tp -63.57 -38.35 90.79 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.837 HD11 HG22 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -59.71 -47.15 86.8 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.465 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.493 ' HG2' HD13 ' A' ' 452' ' ' LEU . 4.8 mm-40 -70.38 -31.78 69.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.893 177.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.588 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.32 -40.17 96.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.222 -178.581 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.62 -44.2 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.222 0.534 . . . . 0.0 109.909 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.836 HD11 HG23 ' A' ' 445' ' ' ILE . 7.0 tp -66.36 -41.0 90.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.78 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.43 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 94.9 m -62.69 -30.36 71.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -71.01 -44.65 65.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.596 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.799 ' O ' HD12 ' A' ' 423' ' ' LEU . 15.8 pt-20 -64.23 -44.64 91.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.625 0.25 . . . . 0.0 111.41 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.961 ' HB2' HD13 ' A' ' 445' ' ' ILE . 1.4 pp -66.27 -35.34 80.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.893 0.378 . . . . 0.0 110.511 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.59 HD12 ' CD1' ' A' ' 420' ' ' LEU . 3.9 mp -70.31 -31.87 69.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.446 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.53 -46.28 90.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 419' ' ' GLU . 1.8 mp -66.12 -31.01 71.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.719 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -58.37 -26.5 63.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.01 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.05 38.35 1.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.863 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 14.2 p -91.19 130.02 41.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.64 -70.13 0.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.984 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.509 ' OG1' HG11 ' A' ' 434' ' ' VAL . 27.5 m 67.25 -69.5 0.13 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.028 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 98.37 -60.58 0.92 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 177.76 38.39 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.421 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.528 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.9 OUTLIER -93.43 120.08 33.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.818 0.342 . . . . 0.0 110.926 -179.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -31.07 69.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 21.5 t -65.42 -42.03 92.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.932 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.528 HG23 ' HB3' ' A' ' 431' ' ' GLN . 39.9 t -68.29 -37.45 77.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.92 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.755 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.16 -34.37 74.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.924 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.04 -45.16 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.504 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.0 OUTLIER -66.45 -44.24 83.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.972 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -60.46 -39.45 87.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -69.76 -31.71 69.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.727 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.421 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -69.4 -45.66 68.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.11 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 1.005 ' HA ' HD12 ' A' ' 445' ' ' ILE . 25.6 t -64.25 -34.3 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.866 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -45.09 95.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.215 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -37.2 86.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.083 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 1.005 HD12 ' HA ' ' A' ' 442' ' ' VAL . 24.2 mt -64.36 -32.73 58.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.704 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.58 -47.59 83.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.011 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.84 -42.45 93.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.17 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.413 ' CG2' HD22 ' A' ' 416' ' ' LEU . 34.2 mt -63.6 -36.56 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.803 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.417 HD12 ' OE2' ' A' ' 413' ' ' GLU . 2.3 tp -57.58 -47.59 81.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.817 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -34.53 68.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -57.87 -33.2 68.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.987 0.422 . . . . 0.0 110.313 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.83 HD21 HD12 ' A' ' 412' ' ' LEU . 1.8 mt -77.66 -36.79 51.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.434 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.92 -29.87 63.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.791 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -22.2 17.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.059 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -82.43 -19.88 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.958 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -86.32 -103.51 0.76 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.418 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.963 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.159 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.551 HG22 HD11 ' A' ' 384' ' ' ILE . 6.0 mt -58.85 -29.91 41.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.468 ' HA ' HG12 ' A' ' 384' ' ' ILE . 1.3 mttt -56.96 -33.15 66.76 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.868 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.593 ' O ' HG23 ' A' ' 386' ' ' VAL . 2.8 mttm -66.69 -38.04 85.98 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 33.7 mm -60.52 -35.59 64.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.293 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.586 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.91 -44.55 44.9 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.387 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.516 178.383 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -49.25 75.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.782 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.774 HG11 ' HB3' ' A' ' 423' ' ' LEU . 46.5 t -63.77 -33.65 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.672 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.25 -37.84 84.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.558 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 10.3 mt-10 -62.6 -34.64 77.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.744 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -67.58 -34.66 77.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.477 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.714 HG22 HD11 ' A' ' 445' ' ' ILE . 32.4 t -66.21 -46.69 86.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.2 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 11.7 pt20 -62.89 -40.47 97.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.863 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . 0.415 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 0.2 OUTLIER -68.92 -44.18 73.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.855 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.729 ' O ' HG23 ' A' ' 397' ' ' VAL . 1.1 mm? -58.57 -40.26 82.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.764 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -59.8 -46.61 88.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.018 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.5 -36.14 75.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.14 -41.73 76.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.388 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 393' ' ' LEU . 19.7 t -60.57 -45.75 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.328 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -24.12 31.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.006 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.835 ' O ' HG23 ' A' ' 401' ' ' VAL . 22.6 tt0 -95.77 -55.72 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 1.003 ' CE1' HD22 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -51.85 -27.08 11.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 -179.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.835 HG23 ' O ' ' A' ' 399' ' ' GLU . 21.1 t 66.4 -44.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.627 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.559 ' CA ' ' CZ ' ' A' ' 400' ' ' PHE . . . 68.22 158.22 1.18 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.013 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.534 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.3 143.6 49.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.601 179.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -67.68 -15.05 63.45 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.6 t -115.54 8.96 15.28 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 35.9 t0 -100.67 136.6 40.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.833 0.349 . . . . 0.0 110.8 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.763 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.31 -31.8 71.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.887 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.97 -29.03 70.5 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.712 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.534 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -65.9 -45.31 82.42 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.763 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.9 p-90 -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.177 178.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.581 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 18.0 tp -69.65 -38.89 77.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.642 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 1.003 HD22 ' CE1' ' A' ' 400' ' ' PHE . 0.3 OUTLIER -62.55 -46.99 85.86 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.141 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.852 ' HG2' HD13 ' A' ' 452' ' ' LEU . 21.5 mt-10 -70.32 -32.42 70.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.429 177.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.581 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 4.5 mt-10 -66.38 -44.6 82.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.9 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 412' ' ' LEU . 8.3 ptm -65.71 -42.43 91.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.679 0.276 . . . . 0.0 111.312 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.658 HD21 ' HA ' ' A' ' 413' ' ' GLU . 3.1 pp -67.24 -36.69 82.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.907 0.384 . . . . 0.0 110.663 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.572 ' N ' HD12 ' A' ' 416' ' ' LEU . 0.7 OUTLIER -62.79 -33.89 76.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.737 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . 0.637 ' HA ' HD12 ' A' ' 421' ' ' LEU . 7.8 mttt -73.06 -34.15 66.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.052 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 416' ' ' LEU . 7.7 pt-20 -72.83 -38.31 67.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.849 HD12 ' N ' ' A' ' 421' ' ' LEU . 4.3 pp -70.5 -43.71 69.13 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.986 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.56 -31.45 68.48 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.163 -179.288 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . 0.986 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.1 OUTLIER -64.35 -46.72 82.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.82 0.343 . . . . 0.0 111.47 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.774 ' HB3' HG11 ' A' ' 386' ' ' VAL . 1.9 pp -68.02 -30.94 70.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.167 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 -3.83 41.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.525 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.2 m -86.16 -5.03 59.28 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.553 0.216 . . . . 0.0 111.56 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 423' ' ' LEU . 26.8 m -66.68 137.82 24.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.864 0.364 . . . . 0.0 111.066 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -73.06 156.49 38.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.887 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 69.1 p -137.24 110.68 7.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.907 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -82.43 -37.0 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.439 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 172.81 49.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.486 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.405 ' HB3' HG23 ' A' ' 434' ' ' VAL . 15.9 mt-30 -126.73 111.33 14.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.772 0.32 . . . . 0.0 110.93 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -67.1 -32.45 73.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.929 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -40.94 96.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 431' ' ' GLN . 25.8 t -71.57 -39.82 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.093 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -44.67 90.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.745 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.53 -43.17 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.161 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.18 91.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.754 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.429 ' O ' HG23 ' A' ' 442' ' ' VAL . 10.1 ptt85 -70.31 -40.42 74.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.68 0.276 . . . . 0.0 111.042 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.84 -32.91 74.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.07 -41.98 63.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.401 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -62.03 -45.57 92.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.21 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.771 HG13 ' HB2' ' A' ' 420' ' ' LEU . 46.2 t -69.55 -38.83 77.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.712 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.36 -39.21 93.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.873 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -63.19 -40.72 98.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.515 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.714 HD11 HG22 ' A' ' 390' ' ' VAL . 0.5 OUTLIER -63.81 -31.18 52.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.798 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -64.2 -41.04 97.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.879 179.327 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.62 -37.27 83.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.237 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 31.7 mt -67.3 -36.4 76.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.58 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 446' ' ' GLN . 1.8 mt -57.29 -46.99 82.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.5 -46.13 89.83 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -58.43 -30.02 66.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.241 0.543 . . . . 0.0 109.614 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.876 HD11 HD23 ' A' ' 412' ' ' LEU . 1.0 OUTLIER -77.29 -36.77 53.89 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.335 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -61.73 -31.8 71.99 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.38 -19.35 20.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.971 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.9 mtmt -82.45 -23.37 34.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.353 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.422 ' HA2' ' O ' ' A' ' 402' ' ' GLY . . . -72.32 -93.13 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.6 mp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.217 179.796 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 63.7 m . . . . . 0 CA--C 1.52 -0.175 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.639 HG22 HD11 ' A' ' 384' ' ' ILE . 34.1 mm -58.68 -30.11 41.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.418 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -59.0 -33.32 70.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.884 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.453 ' O ' HG23 ' A' ' 386' ' ' VAL . 7.5 mtpp -68.19 -38.12 81.66 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.17 0.509 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 37.9 mm -60.45 -34.55 58.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.411 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.639 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.95 -44.72 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.414 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -47.19 80.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.009 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.495 HG12 HD21 ' A' ' 423' ' ' LEU . 47.5 t -70.39 -42.85 78.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.124 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.08 -38.88 92.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.771 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -62.75 -34.71 77.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -40.9 96.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.389 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.57 HG13 ' CD1' ' A' ' 445' ' ' ILE . 56.2 t -61.42 -37.94 78.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.591 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -41.13 93.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.71 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -72.53 -44.54 62.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.642 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.667 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.5 mm? -59.01 -42.48 90.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.755 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.28 -44.33 95.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -35.86 77.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.015 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -45.02 71.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.792 HG21 ' CG2' ' A' ' 448' ' ' ILE . 17.1 t -60.58 -39.6 81.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.975 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -58.52 -38.91 78.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.012 0.434 . . . . 0.0 110.333 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -80.67 -54.45 5.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.349 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.616 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 42.8 t80 -21.4 116.86 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.401 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 25.5 m -111.21 27.03 2.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.192 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.616 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -54.72 -172.82 0.08 OUTLIER Glycine 0 N--CA 1.442 -0.962 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.326 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.515 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.89 143.86 48.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.781 -0.71 . . . . 0.0 111.236 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.406 ' HB2' ' CA ' ' A' ' 457' ' ' LEU . 0.0 OUTLIER -52.25 -27.38 14.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.525 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.32 11.32 29.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.599 -179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -93.17 142.67 27.04 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.784 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.19 -30.29 70.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.983 0.42 . . . . 0.0 110.665 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -68.0 -29.16 68.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.836 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.515 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -66.52 -45.29 79.99 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.784 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 9.3 p-90 -72.67 -30.58 64.39 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 119.045 -1.062 . . . . 0.0 109.13 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.591 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.8 tp -69.79 -38.49 76.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.303 177.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.594 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -63.03 -47.07 84.63 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.092 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.504 ' HA ' HD21 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.33 -32.04 69.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.372 177.86 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.87 -41.46 97.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.49 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 18.5 ptp -69.58 -44.54 70.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.637 0.256 . . . . 0.0 111.448 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.737 HD12 ' N ' ' A' ' 417' ' ' THR . 4.3 pp -66.48 -37.1 84.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.884 0.373 . . . . 0.0 110.231 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.737 ' N ' HD12 ' A' ' 416' ' ' LEU . 99.2 m -62.85 -30.39 71.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.208 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . 0.58 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -72.24 -32.65 66.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.913 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.589 ' O ' HD12 ' A' ' 423' ' ' LEU . 6.8 mm-40 -72.72 -46.38 53.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.307 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 421' ' ' LEU . 2.5 pp -62.96 -46.21 88.79 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.21 -178.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.985 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -68.2 -31.44 70.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 110.817 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . 0.985 ' N ' HD13 ' A' ' 421' ' ' LEU . 1.3 tm-20 -58.33 -46.44 86.19 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.842 0.353 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.672 HD22 ' HB3' ' A' ' 441' ' ' ALA . 0.7 OUTLIER -69.08 -33.56 73.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.75 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -68.06 -28.3 67.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.962 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.5 p -96.57 38.53 1.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . 0.625 HG11 ' HG3' ' A' ' 438' ' ' ARG . 10.2 p -86.14 137.78 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.85 110.03 16.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.04 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.3 t -156.02 121.7 4.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.16 -49.25 2.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.476 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -136.32 62.96 0.59 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.498 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.596 ' HB3' HG23 ' A' ' 434' ' ' VAL . 41.1 mt-30 -139.27 84.94 2.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.823 0.344 . . . . 0.0 110.922 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.56 -31.89 69.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -42.32 99.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.596 HG23 ' HB3' ' A' ' 431' ' ' GLN . 30.8 t -66.33 -45.6 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.068 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.78 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -68.14 -47.21 68.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.884 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.1 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.008 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.833 ' O ' HG23 ' A' ' 442' ' ' VAL . 17.7 mmt180 -67.61 -36.64 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -66.94 -44.77 79.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.722 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.91 -34.7 76.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.672 ' HB3' HD22 ' A' ' 423' ' ' LEU . . . -70.32 -45.02 67.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.041 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.833 HG23 ' O ' ' A' ' 438' ' ' ARG . 24.9 t -62.92 -45.91 97.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.99 -34.11 74.29 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.526 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.06 -36.4 83.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.944 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.78 ' HA ' HD12 ' A' ' 448' ' ' ILE . 1.7 mm -68.42 -31.31 50.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.292 179.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.63 -47.69 83.52 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.762 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.68 -35.36 80.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.425 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.792 ' CG2' HG21 ' A' ' 397' ' ' VAL . 10.3 mt -74.58 -36.44 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.772 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.4 -55.4 35.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.687 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.07 -37.92 81.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.24 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 7.0 mtmm -57.86 -31.6 66.84 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.654 HD23 HG13 ' A' ' 397' ' ' VAL . 1.5 tm? -68.38 -38.95 81.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.393 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -60.81 -30.0 69.8 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.23 -15.74 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.131 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -22.65 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 110.837 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.68 -100.61 0.71 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.406 ' CA ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.993 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.519 -0.231 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.737 ' HA ' HD12 ' A' ' 383' ' ' ILE . 32.8 mm -58.71 -29.84 40.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.462 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -37.28 70.82 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.16 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -64.59 -38.19 90.16 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.028 0.442 . . . . 0.0 111.185 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 380' ' ' ILE . 16.6 mt -61.19 -35.24 64.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.328 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.629 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -75.05 -44.78 43.83 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.332 178.463 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -56.69 -49.41 75.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.918 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.752 HG21 HD11 ' A' ' 423' ' ' LEU . 8.4 p -65.69 -42.93 93.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.859 179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.649 HD23 HE21 ' A' ' 391' ' ' GLN . 0.4 OUTLIER -67.57 -32.65 73.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.784 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -35.18 79.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . 0.4 ' CD ' ' HB3' ' A' ' 419' ' ' GLU . 0.3 OUTLIER -70.38 -44.43 68.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.62 179.446 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 387' ' ' LEU . 1.6 p -66.45 -35.91 76.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.634 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.649 HE21 HD23 ' A' ' 387' ' ' LEU . 1.0 OUTLIER -60.16 -40.66 90.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.533 179.628 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -35.07 68.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.83 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -68.87 -43.57 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.121 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 395' ' ' GLN . 0.1 OUTLIER -68.07 -33.28 74.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.777 0.323 . . . . 0.0 110.788 179.933 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . 0.425 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 1.8 tt0 -66.44 -35.59 80.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -69.1 -37.56 78.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.812 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.861 HG21 ' CG2' ' A' ' 448' ' ' ILE . 16.2 t -60.61 -40.49 84.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -55.86 -32.98 64.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.053 0.454 . . . . 0.0 110.301 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.43 ' O ' ' C ' ' A' ' 400' ' ' PHE . 30.6 tt0 -88.91 -54.34 4.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.296 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.672 ' CD1' HD23 ' A' ' 412' ' ' LEU . 35.1 t80 -20.84 124.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.131 -0.94 . . . . 0.0 113.299 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.0 p -120.9 24.77 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.392 178.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.636 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -59.61 -171.11 0.45 Allowed Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.949 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.83 143.45 48.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.288 -0.456 . . . . 0.0 111.354 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.463 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -53.1 -26.96 18.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.225 179.41 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.88 14.6 30.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.19 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -106.64 147.81 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.886 0.374 . . . . 0.0 110.957 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.794 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 2.3 ttpt -61.17 -30.33 70.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.691 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -66.09 -29.24 69.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.144 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 52.5 t80 -70.88 -45.94 63.49 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.794 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -72.97 -30.56 63.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 118.612 -1.235 . . . . 0.0 108.568 177.716 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 39.1 tp -66.41 -40.03 89.34 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.016 177.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.672 HD23 ' CD1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.79 -47.04 87.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.613 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.527 ' HA ' HD21 ' A' ' 416' ' ' LEU . 29.8 mt-10 -70.32 -31.99 69.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.779 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.602 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.52 -41.41 98.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.712 -178.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.652 ' HB2' HD11 ' A' ' 393' ' ' LEU . 6.5 mmm -69.53 -44.67 70.49 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.906 0.384 . . . . 0.0 110.936 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.699 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -68.59 -36.83 79.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.158 179.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.71 ' HA ' HD23 ' A' ' 420' ' ' LEU . 95.4 m -72.03 -30.32 65.07 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.595 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -62.58 -47.45 83.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.572 -179.651 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 416' ' ' LEU . 1.2 pp20? -65.3 -46.44 80.35 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.71 HD23 ' HA ' ' A' ' 417' ' ' THR . 0.3 OUTLIER -60.55 -34.51 74.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.102 0.477 . . . . 0.0 109.877 179.303 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.35 -31.77 69.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.179 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.23 -46.41 85.95 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.376 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.914 ' O ' HG13 ' A' ' 426' ' ' VAL . 1.3 mt -70.29 -45.74 65.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.614 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 40.88 37.36 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.745 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.0 t 59.75 55.09 4.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . 0.914 HG13 ' O ' ' A' ' 423' ' ' LEU . 3.6 m -66.38 117.65 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.056 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.32 149.91 27.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.052 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . 0.519 HG23 ' NH1' ' A' ' 438' ' ' ARG . 72.4 p -110.86 -27.14 8.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.994 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 106.81 -27.19 17.14 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.354 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 168.42 41.27 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.27 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.44 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -116.46 96.86 5.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 0.0 110.958 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.86 -31.79 72.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.815 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.28 -43.85 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.835 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.555 HG12 ' CD ' ' A' ' 438' ' ' ARG . 38.8 t -68.08 -37.99 79.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -40.76 87.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -66.14 -38.3 87.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.787 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.68 -38.73 73.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.027 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.875 ' O ' HG23 ' A' ' 442' ' ' VAL . 6.0 mtp180 -62.13 -44.43 96.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.81 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -66.48 -37.05 84.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.81 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.47 -39.6 88.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.917 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.47 69.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.078 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 438' ' ' ARG . 31.8 t -62.88 -44.98 99.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.84 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.5 m -60.85 -34.91 75.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.236 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -63.16 -34.62 78.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.507 HG21 ' CD2' ' A' ' 420' ' ' LEU . 3.4 mm -66.35 -36.63 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-O 121.249 0.547 . . . . 0.0 110.531 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.92 -47.72 84.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.187 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.79 87.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.082 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.861 ' CG2' HG21 ' A' ' 397' ' ' VAL . 15.7 mt -73.52 -36.54 48.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.39 -46.67 83.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.905 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -38.33 70.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.524 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.85 -30.07 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.118 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.636 HD12 ' O ' ' A' ' 448' ' ' ILE . 2.1 mt -77.58 -36.62 51.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.594 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -29.96 60.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.857 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -96.6 -12.35 24.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.332 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.53 -24.02 34.29 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.746 0.308 . . . . 0.0 110.846 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.457 ' HA2' ' HA ' ' A' ' 403' ' ' LYS . . . -92.42 -76.19 1.32 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.632 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 93.6 p . . . . . 0 CA--C 1.519 -0.217 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.683 HG22 HD11 ' A' ' 384' ' ' ILE . 27.7 mm -58.76 -29.82 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.456 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.36 -33.25 67.59 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.983 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 386' ' ' VAL . 7.0 mttm -68.23 -38.1 81.5 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.174 0.512 . . . . 0.0 110.782 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.558 HD12 HD13 ' A' ' 380' ' ' ILE . 50.2 mt -60.5 -34.14 57.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.433 178.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.683 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.94 -44.8 44.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.469 178.649 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -58.57 -49.4 77.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.084 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.761 HG11 ' HB3' ' A' ' 423' ' ' LEU . 46.8 t -68.31 -46.17 81.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.156 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.846 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.77 -34.88 78.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.21 0.529 . . . . 0.0 109.834 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -38.96 81.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.506 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 386' ' ' VAL . 24.3 t -67.3 -36.0 75.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.741 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -41.11 96.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.664 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.82 -45.6 67.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.544 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.709 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -60.84 -38.0 83.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.59 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -60.68 -42.03 96.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.698 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -58.06 -44.82 87.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.827 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.25 -45.25 70.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.775 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 393' ' ' LEU . 58.2 t -60.64 -32.55 51.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.706 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.12 -34.72 76.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.044 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' O ' ' A' ' 400' ' ' PHE . 6.6 tt0 -91.43 -68.62 0.78 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.17 179.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.786 ' CE1' HD13 ' A' ' 412' ' ' LEU . 4.7 t80 54.55 157.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.591 0.71 . . . . 0.0 111.888 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 5.0 m -141.12 20.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.853 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.567 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -104.08 -170.46 25.12 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.889 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -134.14 143.93 48.24 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.58 -0.31 . . . . 0.0 111.68 -179.545 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 3.2 tttt -51.13 -28.77 11.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.138 179.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.74 14.34 32.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.391 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.19 164.97 11.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.816 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.41 -30.8 66.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.14 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.02 -29.14 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.027 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 18.5 t80 -69.38 -45.43 69.34 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.816 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.75 64.34 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.903 178.18 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -68.1 -39.33 82.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.454 177.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.786 HD13 ' CE1' ' A' ' 400' ' ' PHE . 10.0 tp -61.28 -46.85 88.64 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.33 -31.9 69.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.657 177.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 0.4 OUTLIER -63.38 -44.6 94.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.959 -179.166 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 6.3 ptp -66.29 -36.9 84.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.071 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.471 HD12 ' O ' ' A' ' 416' ' ' LEU . 8.5 tp -68.69 -41.91 78.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.493 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -32.83 73.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.843 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.55 -47.19 76.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.522 ' CD ' HD13 ' A' ' 393' ' ' LEU . 15.3 pt-20 -66.29 -40.3 89.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.902 0.382 . . . . 0.0 110.704 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.853 HD22 HD11 ' A' ' 423' ' ' LEU . 1.0 OUTLIER -66.46 -33.58 76.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.094 0.473 . . . . 0.0 110.381 179.561 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.64 -31.79 68.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.102 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -46.52 73.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.32 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 1.03 HD22 ' HB1' ' A' ' 441' ' ' ALA . 3.3 pp -65.24 -31.18 72.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.339 . . . . 0.0 110.939 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . 0.625 ' N ' HD12 ' A' ' 423' ' ' LEU . 12.4 t70 -70.09 -26.82 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 1.8 t -57.96 -25.92 61.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.159 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 23.7 t -66.63 134.86 29.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.89 0.376 . . . . 0.0 111.098 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -101.82 -177.79 3.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -151.13 138.38 19.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.86 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.87 28.27 16.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.547 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 97.16 43.68 2.97 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.467 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.695 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.3 mm-40 -116.43 129.05 56.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.862 0.363 . . . . 0.0 110.831 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -67.19 -37.45 83.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.34 -43.93 95.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.817 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.695 HG23 ' HB3' ' A' ' 431' ' ' GLN . 29.4 t -60.64 -46.1 96.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.08 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -34.3 74.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.782 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -64.71 -34.31 78.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.829 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.56 -43.64 69.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.155 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.776 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.3 mmp_? -61.89 -44.53 96.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.924 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.49 -43.09 99.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.012 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.45 -45.0 95.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.074 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 1.03 ' HB1' HD22 ' A' ' 423' ' ' LEU . . . -70.88 -45.58 64.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.319 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 438' ' ' ARG . 38.5 t -69.37 -30.7 46.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.025 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 54.1 t -70.66 -43.09 69.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.78 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.83 -44.58 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.062 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.85 HG12 HD23 ' A' ' 420' ' ' LEU . 2.8 pp -63.27 -31.12 51.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.765 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.609 ' N ' HD12 ' A' ' 445' ' ' ILE . 5.8 tp-100 -64.48 -46.57 82.48 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.631 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -58.97 -36.79 75.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.682 HG22 HG11 ' A' ' 397' ' ' VAL . 24.4 mt -66.78 -36.53 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.9 tt -57.64 -58.71 7.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.813 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.94 -38.05 81.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.415 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.4 mmpp? -57.94 -29.88 65.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.636 ' HG ' HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -71.33 -38.86 71.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.525 179.311 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.68 -29.98 65.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.121 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -20.7 23.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -20.6 36.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.768 0.318 . . . . 0.0 110.981 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.46 -90.33 0.18 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.329 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.216 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.662 HG22 HD11 ' A' ' 384' ' ' ILE . 1.7 mp -58.6 -29.58 39.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.443 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.8 OUTLIER -56.94 -33.85 67.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.252 -179.517 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -68.43 -38.11 80.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.127 0.489 . . . . 0.0 110.827 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.691 HG13 HG13 ' A' ' 434' ' ' VAL . 40.7 mm -60.52 -33.98 56.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.524 178.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.662 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.94 -44.78 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.584 178.582 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . 0.415 ' CG ' ' N ' ' A' ' 386' ' ' VAL . 0.0 OUTLIER -59.26 -49.47 77.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.511 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.904 HG21 ' HG ' ' A' ' 423' ' ' LEU . 14.7 p -64.0 -43.5 97.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.59 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.448 ' N ' HG13 ' A' ' 386' ' ' VAL . 2.2 tt -60.7 -34.43 74.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.384 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 3.2 mt-10 -62.8 -35.01 78.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.519 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 -34.48 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.55 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.452 HG13 HG22 ' A' ' 445' ' ' ILE . 22.5 t -61.63 -46.85 95.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.488 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.6 pt20 -64.98 -35.51 81.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.836 0.35 . . . . 0.0 110.797 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -40.8 74.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.632 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.545 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -64.0 -41.7 97.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.618 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.21 -38.54 83.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.22 -35.34 80.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.826 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -69.27 -39.9 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 393' ' ' LEU . 23.5 t -60.71 -44.85 98.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.028 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -55.76 -40.32 72.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 400' ' ' PHE . 15.3 tt0 -78.19 -53.93 6.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.304 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.604 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 35.1 t80 -22.65 123.28 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.09 -0.959 . . . . 0.0 113.145 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 401' ' ' VAL . 11.6 p -118.33 24.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.444 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.604 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -61.09 -169.37 0.58 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.941 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.556 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 0.3 OUTLIER -133.7 143.64 48.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.498 . . . . 0.0 111.17 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.406 ' N ' ' HA3' ' A' ' 456' ' ' GLY . 0.2 OUTLIER -50.16 -27.99 6.7 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.593 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.87 11.99 19.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 29.8 t70 -93.5 154.61 17.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 110.963 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -32.72 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.557 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -63.0 -45.9 90.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.897 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.556 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 11.8 t80 -61.34 -44.53 97.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.919 0.39 . . . . 0.0 110.672 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.481 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -59.13 -48.65 80.84 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.2 tp -65.01 -38.47 91.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.76 HD12 HD13 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.04 -47.43 86.43 Favored 'General case' 0 C--N 1.339 0.113 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -70.68 -32.29 69.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.572 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.6 mt-10 -63.7 -39.65 94.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.838 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 1.6 ttt -69.45 -42.01 75.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.959 0.409 . . . . 0.0 110.167 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.69 HD12 HD12 ' A' ' 449' ' ' LEU . 0.9 OUTLIER -61.04 -40.41 93.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.549 179.548 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.578 ' HA ' HD21 ' A' ' 420' ' ' LEU . 2.7 m -64.13 -32.97 74.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.446 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . 0.725 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -73.12 -23.58 60.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.891 ' HG2' HG21 ' A' ' 445' ' ' ILE . 0.4 OUTLIER -72.81 -46.64 52.08 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.056 -179.748 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.812 ' HB2' HG13 ' A' ' 442' ' ' VAL . 0.8 OUTLIER -64.79 -50.19 67.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.242 -178.965 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.981 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -64.29 -31.38 72.57 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.176 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . 0.981 ' N ' HD13 ' A' ' 421' ' ' LEU . 5.3 tp10 -64.25 -38.77 92.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.904 ' HG ' HG21 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -73.83 -31.19 63.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.007 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -74.16 -28.15 61.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.966 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 83.1 p -98.69 39.73 1.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 423' ' ' LEU . 23.8 t -101.07 136.74 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.35 138.8 58.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.9 p -153.94 163.7 39.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.925 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -173.75 98.67 0.13 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.17 49.74 55.7 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.466 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.462 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.8 mt-30 -147.76 87.25 1.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.838 0.351 . . . . 0.0 110.952 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -64.58 -33.88 76.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.928 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 9.5 m -60.54 -44.74 95.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.923 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.691 HG13 HG13 ' A' ' 383' ' ' ILE . 32.6 t -66.53 -36.13 76.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.44 -39.15 85.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.861 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -69.1 -32.93 72.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.951 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.82 -45.23 62.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.237 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -62.23 -31.53 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.56 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -67.97 -37.52 81.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.885 ' HB3' HD22 ' A' ' 423' ' ' LEU . . . -61.87 -45.66 92.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.865 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.812 HG13 ' HB2' ' A' ' 420' ' ' LEU . 57.8 t -66.99 -36.31 76.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 16.0 m -70.9 -46.77 61.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.658 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -44.57 89.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.892 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.891 HG21 ' HG2' ' A' ' 419' ' ' GLU . 2.8 pp -63.21 -31.36 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.191 0.52 . . . . 0.0 110.294 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.545 ' N ' HD12 ' A' ' 445' ' ' ILE . 4.8 tp-100 -59.09 -47.73 84.19 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.586 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.13 -37.41 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.335 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.48 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.9 mt -69.08 -36.36 73.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.594 179.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.69 HD12 HD12 ' A' ' 416' ' ' LEU . 6.2 tt -57.49 -47.28 82.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.66 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -37.84 88.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.246 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -30.14 65.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.803 178.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.76 HD13 HD12 ' A' ' 412' ' ' LEU . 4.8 tp -73.09 -36.69 66.84 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.291 179.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -57.07 -29.92 63.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.477 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm -92.85 -12.45 31.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.29 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -25.48 33.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.925 0.393 . . . . 0.0 110.361 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.406 ' HA3' ' N ' ' A' ' 404' ' ' LYS . . . -76.41 -70.19 1.31 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.459 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.946 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 29.1 t . . . . . 0 CA--C 1.519 -0.247 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.718 ' HA ' HD12 ' A' ' 383' ' ' ILE . 33.5 mm -58.76 -29.7 40.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.471 ' HA ' HG12 ' A' ' 384' ' ' ILE . 4.0 mtpt -57.03 -33.19 66.95 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.019 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.535 ' O ' HG23 ' A' ' 386' ' ' VAL . 17.2 mttt -66.7 -38.05 85.97 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.196 0.522 . . . . 0.0 110.841 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.718 HD12 ' HA ' ' A' ' 380' ' ' ILE . 18.9 mt -60.5 -35.74 65.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.308 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.639 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -75.03 -44.65 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.592 178.53 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -58.08 -49.38 77.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.893 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.548 HG11 ' HB3' ' A' ' 423' ' ' LEU . 41.1 t -69.23 -46.09 78.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.079 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.16 -36.46 81.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.941 0.4 . . . . 0.0 110.502 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.82 -34.76 77.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.739 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -36.36 74.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.785 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.796 HG22 ' CD ' ' A' ' 419' ' ' GLU . 15.6 t -66.84 -46.75 84.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.063 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.407 ' HG3' ' N ' ' A' ' 392' ' ' TYR . 12.4 pt20 -61.79 -37.5 84.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.627 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . 0.407 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 15.3 t80 -72.4 -47.98 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.807 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.41 ' HB3' HD22 ' A' ' 416' ' ' LEU . 4.4 mt -60.73 -39.36 88.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . 0.406 ' OE1' HD11 ' A' ' 448' ' ' ILE . 47.9 tt0 -61.3 -40.66 94.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.751 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -31.83 73.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.737 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -68.79 -40.37 79.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.792 HG21 ' CG2' ' A' ' 448' ' ' ILE . 30.3 t -60.64 -40.13 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.784 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.58 -37.0 70.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.119 0.485 . . . . 0.0 110.371 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -83.57 -54.38 4.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.254 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.679 ' CE1' HD23 ' A' ' 412' ' ' LEU . 51.2 t80 -27.69 109.18 0.04 OUTLIER 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.023 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 401' ' ' VAL . 20.4 t -102.36 26.36 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.298 178.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.629 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -56.3 -175.91 0.25 Allowed Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.118 -179.269 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.496 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.66 48.25 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.819 -0.69 . . . . 0.0 111.511 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.444 ' HG2' ' CZ ' ' A' ' 409' ' ' TYR . 0.9 OUTLIER -53.5 -26.3 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.423 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 7.9 t -94.95 -15.48 23.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.552 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.454 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 9.2 t70 -77.44 142.29 39.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.78 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 46.2 mttm -61.71 -30.41 70.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.636 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.07 -29.08 70.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.728 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 24.3 t80 -67.77 -45.46 74.83 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.78 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.2 p-90 -72.73 -29.34 63.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.056 178.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.616 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.1 tp -69.54 -40.39 76.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.158 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.721 HD12 HD21 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -59.68 -46.96 87.49 Favored 'General case' 0 C--N 1.339 0.141 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.823 ' HG2' HD22 ' A' ' 452' ' ' LEU . 1.2 mt-10 -70.09 -31.52 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.521 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.6 OUTLIER -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.018 -179.181 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.49 -39.74 77.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.217 0.532 . . . . 0.0 109.896 178.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 1.067 HD12 HG23 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -60.6 -42.72 97.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.881 179.962 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.559 HG22 HD13 ' A' ' 421' ' ' LEU . 3.2 m -65.92 -32.72 74.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.689 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -47.21 84.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.569 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.796 ' CD ' HG22 ' A' ' 390' ' ' VAL . 0.0 OUTLIER -63.55 -34.55 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 0.4 OUTLIER -68.88 -41.2 78.66 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.916 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.559 HD13 HG22 ' A' ' 417' ' ' THR . 5.5 mp -70.75 -31.87 68.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.328 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 -46.55 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.943 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.548 ' HB3' HG11 ' A' ' 386' ' ' VAL . 3.1 pp -58.81 -30.7 67.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.743 0.306 . . . . 0.0 111.261 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -91.75 31.77 1.18 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.371 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.34 -17.58 8.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.446 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.4 m -66.59 137.87 24.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.792 0.33 . . . . 0.0 111.386 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -87.73 86.47 7.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 5.5 p -84.22 131.99 34.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.795 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -93.19 -76.38 1.33 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.532 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -131.61 44.52 1.2 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.415 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.412 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.9 mt-30 -106.99 92.54 4.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.825 0.345 . . . . 0.0 110.883 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -67.55 -40.39 84.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.989 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 76.6 p -58.66 -44.88 90.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.852 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.412 HG23 ' HB3' ' A' ' 431' ' ' GLN . 43.5 t -64.43 -39.89 87.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.981 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -58.88 -42.8 90.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -36.68 83.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.639 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.56 -40.61 95.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.547 ' HB3' HD13 ' A' ' 423' ' ' LEU . 0.0 OUTLIER -66.79 -44.3 81.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.9 mtpp -55.98 -35.25 66.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 110.629 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.05 -32.0 64.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.743 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.56 72.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.071 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.464 HG13 HD21 ' A' ' 420' ' ' LEU . 42.5 t -62.96 -39.21 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -38.56 85.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.517 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -35.45 80.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.353 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 1.067 HG23 HD12 ' A' ' 416' ' ' LEU . 2.5 mm -65.78 -31.2 52.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.707 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -44.45 85.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.442 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.62 -38.44 91.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.839 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.86 ' O ' HD12 ' A' ' 452' ' ' LEU . 15.9 mt -74.67 -36.29 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.878 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.573 HD12 HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.2 -51.64 68.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.675 -179.776 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.47 -33.99 77.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 0.0 110.098 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -59.65 -31.71 69.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.848 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.86 HD12 ' O ' ' A' ' 448' ' ' ILE . 0.4 OUTLIER -73.14 -36.61 66.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.448 179.265 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.21 -30.0 61.72 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.974 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -13.57 23.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.367 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -82.06 -26.26 33.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.171 0.51 . . . . 0.0 110.916 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.66 -97.97 0.74 Allowed Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.598 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.848 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.519 -0.232 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.868 ' O ' HG22 ' A' ' 383' ' ' ILE . 30.6 mm -58.67 -29.9 40.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.79 -33.26 66.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.865 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -65.82 -41.16 92.16 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.325 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.868 HG22 ' O ' ' A' ' 380' ' ' ILE . 5.4 tp -60.68 -32.41 51.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.573 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -75.02 -44.78 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.714 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.98 -49.36 75.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.882 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.462 ' O ' HG23 ' A' ' 390' ' ' VAL . 10.4 p -63.87 -37.34 79.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.861 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.4 tp -67.56 -37.73 83.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.67 -34.67 77.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.744 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -44.58 78.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 386' ' ' VAL . 29.0 t -63.25 -35.95 74.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.136 0.493 . . . . 0.0 110.384 179.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.32 -41.06 88.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.486 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.95 -42.87 99.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.303 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.637 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.0 OUTLIER -58.4 -38.08 76.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.447 179.501 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . 0.71 ' OE1' HD11 ' A' ' 448' ' ' ILE . 15.2 tt0 -59.37 -42.69 92.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.1 -41.1 82.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.779 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 49.3 mm-40 -69.27 -44.51 71.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.971 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.791 HG11 HG22 ' A' ' 448' ' ' ILE . 45.5 t -60.59 -33.45 54.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.532 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -57.01 -34.78 68.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.993 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.0 tt0 -89.99 -67.46 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.764 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.851 ' CD1' HD22 ' A' ' 412' ' ' LEU . 8.2 t80 43.4 111.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.805 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 9.8 m -95.76 23.6 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.157 178.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.526 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.69 -171.46 42.26 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.582 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.455 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.07 143.77 48.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.685 0.279 . . . . 0.0 111.666 -179.696 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.528 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.94 -25.56 30.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.214 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.05 0.37 37.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.436 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -92.14 149.5 21.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.34 . . . . 0.0 110.635 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.783 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.14 -30.16 70.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.852 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.82 -29.17 70.52 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.103 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.528 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.3 t80 -69.57 -45.56 68.41 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.783 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 4.8 p-90 -72.85 -30.99 64.45 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.961 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.619 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 36.6 tp -69.67 -38.4 77.03 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.471 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.851 HD22 ' CD1' ' A' ' 400' ' ' PHE . 11.2 tp -61.66 -47.34 85.81 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.86 ' CG ' HD13 ' A' ' 452' ' ' LEU . 24.7 mt-10 -70.41 -32.7 70.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.304 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.619 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mt-10 -64.01 -35.67 81.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.442 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 28.3 ttp -69.6 -40.66 76.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.653 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.835 HD21 HG21 ' A' ' 448' ' ' ILE . 1.9 mp -60.62 -45.74 92.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -33.45 75.11 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.643 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -59.41 -47.27 86.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.358 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -69.75 -38.11 76.67 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.501 HD13 HG13 ' A' ' 445' ' ' ILE . 27.9 tp -61.35 -39.47 90.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.247 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.34 -31.84 69.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.782 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -46.21 91.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.781 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.24 -35.07 77.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.824 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.12 -31.26 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.803 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.8 t -60.31 -20.79 60.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 22.7 t -66.49 116.77 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.087 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.54 113.72 25.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.959 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 7.4 t -107.87 133.21 52.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -96.24 34.64 4.82 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.482 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 108.69 69.94 0.67 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.426 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.662 ' HG2' HG23 ' A' ' 434' ' ' VAL . 3.0 tt0 -143.19 114.5 7.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.937 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -65.81 -35.27 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 42.2 t -60.14 -44.66 94.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.662 HG23 ' HG2' ' A' ' 431' ' ' GLN . 27.8 t -71.13 -42.89 75.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.995 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -67.78 -35.5 78.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.09 -35.26 76.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.853 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.13 76.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.136 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.0 OUTLIER -68.63 -43.86 75.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.935 179.971 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -59.04 -44.83 91.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.767 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -62.48 -36.28 82.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.645 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.42 76.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.002 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 438' ' ' ARG . 34.2 t -63.11 -45.9 97.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.051 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.91 -34.56 74.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.083 0.468 . . . . 0.0 110.322 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -63.18 -35.74 81.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.339 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.58 ' HA ' HD12 ' A' ' 448' ' ' ILE . 2.6 mm -66.13 -35.51 75.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.473 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -58.25 -47.78 82.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.089 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.63 -37.07 85.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.966 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.835 HG21 HD21 ' A' ' 416' ' ' LEU . 7.8 mt -74.78 -36.5 40.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.144 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.535 ' CD1' HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.39 -54.11 50.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.926 -179.473 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -38.62 91.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.354 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . 0.454 ' O ' ' HD2' ' A' ' 455' ' ' LYS . 3.7 mttm -57.87 -35.19 70.64 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.86 HD13 ' CG ' ' A' ' 413' ' ' GLU . 0.2 OUTLIER -66.46 -36.76 83.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.397 179.071 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.7 -29.91 70.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.789 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.71 -16.25 25.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.845 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.454 ' HD2' ' O ' ' A' ' 451' ' ' LYS . 0.3 OUTLIER -82.46 -22.6 35.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.797 0.332 . . . . 0.0 110.776 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.08 -79.77 0.67 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.374 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.401 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 96.7 p . . . . . 0 CA--C 1.518 -0.276 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.764 HG22 HD11 ' A' ' 384' ' ' ILE . 46.0 mm -58.65 -29.81 40.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 178.489 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.438 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.09 -33.35 67.21 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.052 -179.84 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . 0.705 ' O ' HG23 ' A' ' 386' ' ' VAL . 47.4 mttt -68.25 -38.21 81.55 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.099 0.476 . . . . 0.0 110.873 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.761 HD12 ' HA ' ' A' ' 380' ' ' ILE . 21.6 mt -60.54 -34.98 60.35 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.399 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.764 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.97 -44.72 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.426 178.615 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.04 -49.32 76.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.768 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.8 ' HB ' HD21 ' A' ' 423' ' ' LEU . 19.9 t -67.06 -39.34 83.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.012 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 4.2 tt -67.13 -35.65 80.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.474 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.2 tt0 -62.71 -34.72 77.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.672 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.02 -34.6 73.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.424 179.704 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 386' ' ' VAL . 32.6 t -67.7 -46.87 81.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.096 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 14.4 pt20 -59.46 -41.03 88.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.946 0.403 . . . . 0.0 110.538 179.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.37 -37.39 77.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.231 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.799 HD21 ' HG2' ' A' ' 415' ' ' MET . 0.4 OUTLIER -64.97 -38.66 91.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.381 179.484 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . 0.488 ' HB2' HD11 ' A' ' 448' ' ' ILE . 7.3 tt0 -59.11 -45.07 91.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.461 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -60.98 -33.52 73.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.631 179.562 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.25 -40.7 77.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.813 179.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.932 HG21 ' CG2' ' A' ' 448' ' ' ILE . 24.4 t -60.68 -33.27 54.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.472 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -28.51 64.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.174 0.512 . . . . 0.0 110.135 178.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 24.3 tt0 -91.69 -53.39 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.886 179.119 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.675 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 46.1 t80 -20.78 112.64 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.231 179.823 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.8 p -104.07 26.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.619 178.243 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.675 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -58.91 -177.66 0.93 Allowed Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.781 -0.724 . . . . 0.0 113.065 -179.309 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.518 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.62 48.22 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.834 -0.683 . . . . 0.0 111.543 -179.999 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -52.56 -27.15 15.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.319 179.355 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.5 -15.55 20.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.493 -179.707 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -74.52 144.17 44.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.763 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.1 OUTLIER -62.81 -30.83 71.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.813 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.09 70.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.803 179.565 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.518 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 41.2 t80 -68.36 -45.58 72.43 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.763 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -72.94 -29.37 63.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.949 177.921 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.62 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 20.2 tp -69.61 -38.43 77.26 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.14 177.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.733 HD12 HD21 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.69 -47.32 85.86 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.906 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.449 ' HG3' HD13 ' A' ' 452' ' ' LEU . 3.7 tt0 -70.63 -32.26 69.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.646 177.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.87 -38.97 93.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.198 -179.367 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.799 ' HG2' HD21 ' A' ' 393' ' ' LEU . 50.3 ttp -69.64 -44.79 69.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.339 . . . . 0.0 110.859 -179.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.876 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.49 -37.11 77.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.505 179.641 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.876 ' N ' HD12 ' A' ' 416' ' ' LEU . 1.2 t -70.26 -44.28 68.77 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -61.68 -38.61 88.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.726 0.298 . . . . 0.0 110.931 -179.627 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 18.0 pt-20 -72.27 -46.33 56.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.11 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.755 ' CB ' HG21 ' A' ' 445' ' ' ILE . 1.7 pp -66.61 -34.29 77.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.5 -38.44 89.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.937 179.249 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.89 -44.3 97.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.298 179.51 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.8 HD21 ' HB ' ' A' ' 386' ' ' VAL . 82.1 mt -67.06 -38.08 85.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.708 179.582 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.04 -26.47 65.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.009 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 4.3 p -96.8 38.33 1.23 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.931 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 10.9 p -88.92 133.53 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.45 98.68 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.8 t -114.22 129.55 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.947 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -158.46 100.06 0.19 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.462 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.21 49.89 54.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.458 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.504 ' O ' HG12 ' A' ' 434' ' ' VAL . 32.4 mt-30 -152.2 108.63 3.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.867 0.365 . . . . 0.0 110.926 179.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.69 -28.82 68.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.5 m -59.8 -44.93 93.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.724 -179.34 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 431' ' ' GLN . 10.8 p -72.44 -35.25 51.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 111.328 -179.588 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -42.44 94.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.803 0.335 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -69.29 -32.88 72.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 0.503 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -71.43 -45.23 63.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.199 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.2 ptt85 -68.36 -35.08 77.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.775 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -66.24 -35.79 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.793 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.6 -45.42 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.23 95.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 438' ' ' ARG . 24.5 t -63.33 -31.34 52.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.83 -46.7 62.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.98 179.774 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -67.01 -44.69 79.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.218 -179.796 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.755 HG21 ' CB ' ' A' ' 420' ' ' LEU . 2.0 pp -63.3 -31.08 51.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.98 0.419 . . . . 0.0 110.937 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.09 -44.62 91.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.584 179.692 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.13 77.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.284 -179.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.932 ' CG2' HG21 ' A' ' 397' ' ' VAL . 22.0 mt -73.3 -36.59 49.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.174 -179.9 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.57 -57.64 11.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.026 -179.768 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -33.18 74.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.744 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -31.88 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.976 0.417 . . . . 0.0 110.365 179.6 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.733 HD21 HD12 ' A' ' 412' ' ' LEU . 2.7 mt -77.61 -36.63 51.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.796 179.619 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -56.04 -30.01 61.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.769 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -90.35 -22.43 21.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.737 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -19.2 39.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.031 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.03 -98.9 0.14 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.483 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.89 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 10.7 p . . . . . 0 CA--C 1.518 -0.256 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.554 HG22 HD11 ' A' ' 384' ' ' ILE . 33.2 mm -58.6 -29.76 40.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.547 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.429 ' HA ' HG12 ' A' ' 384' ' ' ILE . 24.6 mttt -59.35 -33.32 71.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.811 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -68.09 -38.07 81.93 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.246 0.546 . . . . 0.0 110.764 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.571 HD12 HG13 ' A' ' 434' ' ' VAL . 40.1 mm -60.48 -33.95 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.477 178.945 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.557 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -74.94 -44.49 44.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.169 178.293 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -56.82 -45.98 81.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.696 179.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.453 HG13 ' N ' ' A' ' 387' ' ' LEU . 13.5 p -69.36 -44.16 80.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.695 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.941 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.3 OUTLIER -66.12 -35.11 79.62 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.745 179.87 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.81 -34.98 78.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.304 0.573 . . . . 0.0 109.526 178.784 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -67.16 -40.78 86.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.591 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.941 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -63.17 -35.62 72.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.817 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.22 -41.07 99.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.816 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -64.23 -44.96 90.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.515 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -58.69 -40.6 84.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.986 179.962 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -60.15 -39.44 86.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.944 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -36.24 82.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.132 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.48 -40.62 85.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.093 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.86 HG21 HG21 ' A' ' 448' ' ' ILE . 18.1 t -60.68 -39.19 80.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 179.891 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.65 -40.37 75.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.979 0.418 . . . . 0.0 110.388 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' C ' ' A' ' 400' ' ' PHE . 17.6 tt0 -77.34 -54.86 5.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.169 179.35 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.557 ' CE1' HD23 ' A' ' 412' ' ' LEU . 41.8 t80 -11.76 110.92 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.525 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.628 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.5 p -104.49 24.92 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.515 178.193 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.524 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -64.4 -169.05 1.71 Allowed Glycine 0 N--CA 1.442 -0.925 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.873 -179.347 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.59 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.86 143.55 48.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.351 -0.424 . . . . 0.0 111.253 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.629 ' HG2' HD23 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -52.79 -24.07 8.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.781 179.853 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . 0.401 HG23 ' HD2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER -105.02 -5.03 21.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.521 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.563 ' OD2' ' HB3' ' A' ' 408' ' ' ALA . 24.3 t70 -77.84 156.13 30.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.788 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 41.0 mtmt -68.97 -32.87 72.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.292 179.587 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.563 ' HB3' ' OD2' ' A' ' 406' ' ' ASP . . . -62.83 -29.2 70.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 178.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 19.8 t80 -63.04 -45.23 93.23 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.827 -179.118 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.788 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.6 OUTLIER -72.62 -27.91 62.44 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 118.763 -1.175 . . . . 0.0 108.74 177.83 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.677 HD12 ' CE3' ' A' ' 410' ' ' TRP . 1.7 mp -66.48 -41.53 88.84 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.28 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.826 HD12 HD13 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -59.82 -46.78 88.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.813 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.403 ' CG ' ' CD2' ' A' ' 449' ' ' LEU . 2.1 tm-20 -70.23 -31.94 69.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.593 177.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.552 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.0 OUTLIER -63.49 -42.22 98.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.339 -179.059 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 4.1 mmt -69.53 -44.33 71.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.078 0.466 . . . . 0.0 110.622 179.622 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.571 HD21 HG21 ' A' ' 397' ' ' VAL . 4.3 mt -61.68 -44.34 97.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 23.7 m -62.58 -30.46 71.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 -179.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . 0.67 ' HA ' HD12 ' A' ' 421' ' ' LEU . 14.7 mttt -64.31 -43.39 94.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.062 0.458 . . . . 0.0 110.261 179.42 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.562 ' O ' HD23 ' A' ' 423' ' ' LEU . 1.0 OUTLIER -72.73 -37.78 67.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.991 179.178 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.912 ' HG ' HG13 ' A' ' 442' ' ' VAL . 0.3 OUTLIER -66.86 -50.51 62.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.385 -179.812 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.982 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.33 -31.5 68.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.986 -179.567 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . 0.982 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.8 OUTLIER -59.64 -46.34 89.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.781 0.324 . . . . 0.0 110.883 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.604 ' HG ' ' HB3' ' A' ' 441' ' ' ALA . 4.3 mm? -65.4 -31.02 71.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.991 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.07 -0.82 41.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.535 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 33.8 p -79.51 -37.25 37.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.825 0.345 . . . . 0.0 110.971 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 27.6 m -74.21 133.77 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.166 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -86.56 -22.22 26.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.069 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.5 t 43.53 85.52 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.525 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.21 46.98 1.64 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.449 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 144.92 52.57 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.465 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.737 ' HG2' HG23 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -164.14 95.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.86 0.362 . . . . 0.0 110.912 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -65.87 -33.93 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.867 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 27.9 t -59.15 -37.45 77.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.737 HG23 ' HG2' ' A' ' 431' ' ' GLN . 30.8 t -74.43 -41.9 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.088 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -44.25 93.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -67.47 -35.76 79.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.046 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 0.408 ' CB ' ' CG2' ' A' ' 383' ' ' ILE . . . -73.11 -45.12 58.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.471 -179.767 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.764 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.1 OUTLIER -66.17 -40.11 90.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.947 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -36.12 82.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.707 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.06 -42.82 62.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.811 179.784 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . 0.697 ' HB2' ' CD2' ' A' ' 387' ' ' LEU . . . -62.01 -45.56 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.912 HG13 ' HG ' ' A' ' 420' ' ' LEU . 43.2 t -65.11 -46.04 92.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.966 0.412 . . . . 0.0 110.813 179.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 8.7 m -61.97 -35.14 77.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.522 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.1 -38.03 89.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.389 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.671 ' HA ' HD12 ' A' ' 448' ' ' ILE . 1.5 mp -67.08 -31.32 52.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.485 ' HA ' HD12 ' A' ' 449' ' ' LEU . 6.8 tp-100 -63.05 -45.79 90.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.712 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.5 -37.62 85.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.86 HG21 HG21 ' A' ' 397' ' ' VAL . 10.1 mt -70.34 -36.41 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.805 179.699 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 446' ' ' GLN . 20.0 mt -57.19 -50.22 73.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.63 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.42 -41.85 75.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 110.123 179.318 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.83 -30.04 65.44 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.544 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.826 HD13 HD12 ' A' ' 412' ' ' LEU . 11.4 tp -71.25 -36.64 71.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.323 179.249 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -56.31 -29.93 61.9 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.587 179.45 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -89.91 -17.13 28.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.904 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -22.41 35.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.717 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.09 -81.61 0.43 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.151 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.629 HD23 ' HG2' ' A' ' 404' ' ' LYS . 2.5 pp . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.947 179.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 CA--C 1.521 -0.149 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.481 HG22 HD11 ' A' ' 384' ' ' ILE . 3.2 mt -58.82 -30.11 41.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.609 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.444 ' HA ' HG12 ' A' ' 384' ' ' ILE . 6.5 mmmt -57.04 -33.23 67.01 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.867 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -38.09 83.69 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.154 0.502 . . . . 0.0 110.808 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.798 HG21 ' HB1' ' A' ' 437' ' ' ALA . 39.4 mm -60.44 -34.33 57.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.445 178.884 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.481 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.86 -44.72 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.396 178.517 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -57.37 -49.1 77.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.573 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.798 HG11 ' HG ' ' A' ' 423' ' ' LEU . 78.1 t -65.97 -40.74 88.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.824 179.634 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.925 ' O ' HG12 ' A' ' 390' ' ' VAL . 3.2 tt -66.01 -35.06 79.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.906 0.384 . . . . 0.0 110.622 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -34.97 78.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -67.75 -39.54 84.17 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.604 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.925 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -64.48 -35.57 74.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.483 179.635 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -41.02 97.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.349 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -67.81 -46.52 71.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.491 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.91 ' O ' HG23 ' A' ' 397' ' ' VAL . 42.7 mt -62.11 -37.97 87.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.487 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -37.36 79.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.645 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -64.04 -42.39 97.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.606 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -69.04 -40.19 78.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.715 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.91 HG23 ' O ' ' A' ' 393' ' ' LEU . 22.1 t -60.6 -36.71 72.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.672 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.61 -35.75 66.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.175 0.512 . . . . 0.0 110.107 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -90.07 -66.83 0.89 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.813 178.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.924 ' CE1' HD13 ' A' ' 412' ' ' LEU . 9.6 t80 31.21 108.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 179.292 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.59 ' O ' HG12 ' A' ' 401' ' ' VAL . 17.4 t -95.49 25.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.165 178.177 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.564 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -87.03 -174.83 49.15 Favored Glycine 0 N--CA 1.442 -0.914 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.683 -179.719 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.7 OUTLIER -134.21 143.69 48.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.603 -0.299 . . . . 0.0 111.755 -179.787 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.502 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.1 -25.62 32.55 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.083 179.151 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.4 m -105.33 14.51 28.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.223 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.75 151.84 24.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.763 179.831 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.739 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.1 -30.26 70.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 -179.827 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -64.4 -29.28 70.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 179.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.502 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 3.5 t80 -71.17 -45.67 62.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.369 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.739 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.1 p-90 -73.07 -29.62 63.09 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.849 177.908 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -69.65 -40.75 76.31 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.768 177.994 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.924 HD13 ' CE1' ' A' ' 400' ' ' PHE . 1.6 tp -61.97 -46.97 86.93 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.078 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.37 -32.2 69.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.758 177.961 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.58 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.3 mm-40 -63.61 -38.66 91.95 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.91 -179.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.454 ' CE ' HD22 ' A' ' 393' ' ' LEU . 42.9 ttp -69.6 -41.59 75.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.994 0.426 . . . . 0.0 110.28 179.332 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.43 HD11 HG22 ' A' ' 445' ' ' ILE . 10.3 tp -62.29 -45.1 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.684 179.661 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.44 HG22 HD13 ' A' ' 421' ' ' LEU . 2.0 m -62.73 -32.59 73.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.712 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -61.46 -42.82 99.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.537 179.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -67.49 -46.4 73.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.282 179.614 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.938 HD21 HG22 ' A' ' 442' ' ' VAL . 2.7 tm? -59.87 -38.53 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.441 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.44 HD13 HG22 ' A' ' 417' ' ' THR . 1.9 mp -64.88 -31.8 73.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.56 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.07 -46.27 88.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.798 ' HG ' HG11 ' A' ' 386' ' ' VAL . 37.3 mt -65.34 -33.99 77.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.869 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -5.18 54.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.3 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 32.2 t -89.37 10.64 21.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.609 0.242 . . . . 0.0 111.374 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 30.0 t -93.54 115.6 32.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.855 0.36 . . . . 0.0 110.912 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -82.14 87.69 6.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.905 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 9.9 t -73.79 149.81 41.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.845 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -127.66 41.31 1.61 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.518 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.11 -27.47 4.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.528 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.652 ' CG ' HG23 ' A' ' 434' ' ' VAL . 47.7 tp60 -58.53 92.48 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 0.0 111.043 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -66.44 -29.71 69.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.1 m -57.74 -44.15 85.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.984 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.652 HG23 ' CG ' ' A' ' 431' ' ' GLN . 29.5 t -64.86 -36.88 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.061 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -62.18 -40.91 97.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.858 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -36.13 77.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 0.798 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -70.87 -45.19 64.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.105 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 442' ' ' VAL . 4.4 ptt180 -69.22 -35.06 75.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -65.46 -39.58 92.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.513 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.27 -38.0 89.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.566 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.0 -42.23 98.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.801 179.812 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.938 HG22 HD21 ' A' ' 420' ' ' LEU . 11.8 t -62.97 -32.51 56.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.833 179.83 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.67 -40.59 72.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.777 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -72.97 -44.59 60.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.856 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.704 HD12 ' N ' ' A' ' 446' ' ' GLN . 2.8 pp -64.66 -31.09 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.076 0.465 . . . . 0.0 110.624 179.575 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.704 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -66.15 -44.03 85.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.449 179.7 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.3 -37.35 80.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.948 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.501 HG22 HG11 ' A' ' 397' ' ' VAL . 29.7 mt -70.99 -36.51 63.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.863 179.737 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -53.22 60.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.942 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.99 -41.07 91.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.466 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.79 -30.6 65.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.59 ' CD1' HD23 ' A' ' 412' ' ' LEU . 4.1 tp -70.37 -36.48 74.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.334 179.124 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -29.73 61.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.598 179.565 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.5 -12.19 30.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.475 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -25.55 33.53 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.896 0.379 . . . . 0.0 110.484 179.708 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.39 -73.7 1.15 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.395 179.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.416 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.852 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.19 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.712 HG22 HD11 ' A' ' 384' ' ' ILE . 31.8 mm -58.75 -29.93 41.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.773 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.45 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -56.92 -33.27 66.78 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.583 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.34 -37.93 81.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.19 0.519 . . . . 0.0 110.473 179.473 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.481 HG21 ' HB1' ' A' ' 437' ' ' ALA . 19.4 mm -60.31 -33.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.441 178.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.712 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.88 -44.68 44.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.471 178.493 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -58.42 -49.36 77.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.686 179.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.887 HG11 ' HB3' ' A' ' 423' ' ' LEU . 77.6 t -65.94 -43.95 92.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.753 179.673 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.44 -35.8 78.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.898 0.38 . . . . 0.0 110.505 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 4.5 mt-10 -62.79 -34.92 78.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.232 0.539 . . . . 0.0 109.637 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.25 -34.52 72.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.569 179.669 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 386' ' ' VAL . 36.8 t -62.42 -46.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.455 -179.714 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.8 pt20 -64.32 -36.34 83.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -34.99 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.188 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.897 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -68.0 -37.91 82.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.261 179.429 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -39.1 79.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.615 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -39.2 80.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.458 179.659 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.4 -44.58 71.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.223 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 393' ' ' LEU . 21.8 t -60.82 -47.49 93.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.414 -179.584 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.66 -29.91 64.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.696 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -87.57 -57.63 2.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.975 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.575 ' CE1' ' HG ' ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.76 128.75 36.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.905 -179.853 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 402' ' ' GLY . 29.4 m -124.37 40.55 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.414 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.526 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.97 -163.44 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.002 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.24 143.67 49.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.01 0.433 . . . . 0.0 111.44 -179.354 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.461 ' HA ' ' CE1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.23 -24.48 27.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.861 -179.888 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.69 14.03 24.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.352 -179.797 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.546 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t0 -95.62 154.07 17.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.37 . . . . 0.0 111.171 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -71.36 -43.48 66.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.704 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.94 -33.1 74.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.535 179.682 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.53 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 4.0 t80 -67.59 -44.24 78.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.287 179.634 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.432 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -56.01 -48.44 75.9 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.43 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -60.11 -37.96 81.58 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.111 176.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.575 ' HG ' ' CE1' ' A' ' 400' ' ' PHE . 0.1 OUTLIER -59.4 -47.73 84.33 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.483 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -71.02 -32.64 69.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.53 177.432 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.16 -46.5 83.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 114.992 -1.003 . . . . 0.0 111.644 -179.312 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.533 ' HE2' HD13 ' A' ' 412' ' ' LEU . 5.5 ptt? -64.56 -39.68 94.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.744 0.306 . . . . 0.0 110.856 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.719 HD23 HD22 ' A' ' 393' ' ' LEU . 3.4 tm? -60.69 -38.41 84.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.926 0.393 . . . . 0.0 110.708 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.527 ' O ' HD13 ' A' ' 421' ' ' LEU . 1.3 m -67.54 -38.53 84.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.114 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.09 -40.92 82.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.004 -179.853 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.447 ' HG3' HD11 ' A' ' 393' ' ' LEU . 0.9 OUTLIER -63.5 -46.34 86.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.013 0.435 . . . . 0.0 110.136 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.811 ' CD2' HG22 ' A' ' 442' ' ' VAL . 2.7 tm? -62.14 -37.34 84.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.442 179.422 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 417' ' ' THR . 7.3 mp -70.5 -31.8 69.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -46.39 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.141 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.887 ' HB3' HG11 ' A' ' 386' ' ' VAL . 4.2 pp -67.91 -30.76 70.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.12 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . 0.807 ' N ' HD12 ' A' ' 423' ' ' LEU . 4.1 t70 -83.92 11.33 7.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.595 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 26.9 t -100.27 -19.02 16.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.682 0.277 . . . . 0.0 111.359 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 423' ' ' LEU . 29.8 m -66.61 137.84 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.903 0.382 . . . . 0.0 111.167 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.86 149.04 29.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.931 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -148.06 118.08 7.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.927 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -78.52 -50.89 5.86 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.985 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -172.22 35.97 0.15 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.421 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . 0.438 ' CD ' HG23 ' A' ' 434' ' ' VAL . 0.7 OUTLIER -97.28 102.59 14.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.875 0.369 . . . . 0.0 110.895 -179.968 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -60.14 -30.53 69.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.886 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -44.86 92.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.857 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.438 HG23 ' CD ' ' A' ' 431' ' ' GLN . 23.4 t -75.11 -42.48 44.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.985 179.93 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -63.08 -39.68 95.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.821 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . 0.412 ' HA ' ' HG2' ' A' ' 439' ' ' LYS . 2.5 tt0 -68.08 -37.58 81.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 0.481 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.08 -34.53 66.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.224 -179.867 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.442 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.1 OUTLIER -69.83 -44.53 69.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.799 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 436' ' ' GLN . 0.0 OUTLIER -64.65 -31.5 72.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 110.509 179.661 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 8.7 tp10 -65.89 -40.06 91.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.52 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.58 92.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.631 179.7 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.811 HG22 ' CD2' ' A' ' 420' ' ' LEU . 12.3 t -62.95 -30.88 50.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.772 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -45.67 65.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.944 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -44.14 96.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.533 HG12 ' HA ' ' A' ' 442' ' ' VAL . 34.3 pt -64.8 -31.22 52.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.043 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.435 ' N ' HG13 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -62.8 -40.95 98.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.223 179.733 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . 0.5 ' HB1' ' HZ1' ' A' ' 451' ' ' LYS . . . -66.51 -35.63 80.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.36 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.86 ' CG2' HG21 ' A' ' 397' ' ' VAL . 19.3 mt -74.8 -36.67 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.665 179.489 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.61 -47.54 81.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.626 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.2 -40.95 90.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.302 179.477 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . 0.5 ' HZ1' ' HB1' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -57.79 -30.11 65.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.086 0.47 . . . . 0.0 109.894 178.956 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.793 ' HG ' HG13 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -76.25 -36.73 58.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.416 179.392 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -41.53 93.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -78.96 -20.99 47.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.186 -179.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.411 ' HE3' HG12 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -82.42 -19.97 37.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.33 -88.44 0.35 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.478 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.516 -0.332 0 CA-C-O 120.653 0.263 . . . . 0.0 111.611 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 380' ' ' ILE . . . . . 0.709 HG22 HD11 ' A' ' 384' ' ' ILE . 3.0 mp -58.66 -29.53 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 381' ' ' LYS . . . . . 0.457 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.8 -33.4 66.63 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.796 179.838 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -68.32 -37.97 81.08 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.221 0.534 . . . . 0.0 110.505 179.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 383' ' ' ILE . . . . . 0.857 HD11 HG13 ' A' ' 434' ' ' VAL . 48.6 mt -60.45 -33.96 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.408 178.827 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 384' ' ' ILE . . . . . 0.709 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.95 -44.67 44.51 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.194 178.424 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -59.49 -49.34 78.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.602 179.721 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 386' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 390' ' ' VAL . 13.7 p -63.83 -35.45 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.368 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.9 tt -67.44 -34.29 76.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.262 179.454 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 388' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 0.3 OUTLIER -62.76 -35.15 78.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.601 179.017 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -35.43 73.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.569 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 390' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 386' ' ' VAL . 32.9 t -69.25 -46.82 76.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 388' ' ' GLU . 14.8 pt20 -58.36 -37.99 76.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.661 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -67.19 -42.86 83.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.435 179.556 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 393' ' ' LEU . . . . . 0.819 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -64.34 -37.92 89.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.332 179.368 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -39.16 81.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.542 179.653 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -63.12 -43.22 99.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.46 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.22 -42.07 76.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.492 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 397' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 393' ' ' LEU . 50.7 t -60.63 -32.17 50.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.398 179.472 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.7 -40.04 86.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.973 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.406 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.9 tt0 -86.51 -68.77 0.72 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.846 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.824 ' CD1' HD22 ' A' ' 412' ' ' LEU . 4.5 t80 57.13 144.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.16 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 401' ' ' VAL . . . . . 0.529 ' O ' HG12 ' A' ' 401' ' ' VAL . 11.9 t -125.98 21.62 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.916 178.701 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 402' ' ' GLY . . . . . 0.601 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -110.93 179.37 20.02 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.472 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 403' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.34 151.43 51.23 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.363 -0.419 . . . . 0.0 111.713 -179.618 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 404' ' ' LYS . . . . . 0.555 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.5 -31.91 25.58 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.128 179.233 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 8.9 t -97.2 15.67 22.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.196 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 406' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 1.8 t70 -115.23 155.06 27.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.848 0.356 . . . . 0.0 110.959 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 407' ' ' LYS . . . . . 0.79 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 4.0 mtmp? -61.72 -30.04 70.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.891 179.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.83 -29.24 70.58 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 409' ' ' TYR . . . . . 0.555 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 10.7 t80 -70.55 -45.81 64.77 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -178.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 410' ' ' TRP . . . . . 0.79 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -72.94 -29.12 62.86 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 118.804 -1.158 . . . . 0.0 108.888 177.979 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 411' ' ' LEU . . . . . 0.592 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 33.3 tp -69.59 -38.66 77.43 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.258 178.091 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.824 HD22 ' CD1' ' A' ' 400' ' ' PHE . 11.6 tp -62.15 -47.17 85.75 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.796 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.49 -32.14 69.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.732 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 414' ' ' GLU . . . . . 0.592 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.62 -46.59 85.04 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -178.982 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 415' ' ' MET . . . . . 0.583 ' HG3' HD12 ' A' ' 416' ' ' LEU . 2.5 ptt? -64.47 -38.72 92.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 110.272 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 416' ' ' LEU . . . . . 0.643 HD13 ' O ' ' A' ' 412' ' ' LEU . 8.7 mp -68.88 -37.17 78.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.632 179.233 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.449 ' HA ' HD23 ' A' ' 420' ' ' LEU . 81.4 m -67.15 -35.67 80.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -179.257 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 418' ' ' LYS . . . . . 0.463 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.1 OUTLIER -72.16 -34.54 68.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.573 0.225 . . . . 0.0 111.594 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 419' ' ' GLU . . . . . 0.753 ' OE1' HD22 ' A' ' 393' ' ' LEU . 9.0 pt-20 -72.2 -41.99 66.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.675 0.274 . . . . 0.0 111.043 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 420' ' ' LEU . . . . . 0.578 HD11 HD12 ' A' ' 421' ' ' LEU . 1.2 pp -67.49 -38.19 83.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.822 0.344 . . . . 0.0 110.755 179.941 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 421' ' ' LEU . . . . . 0.578 HD12 HD11 ' A' ' 420' ' ' LEU . 0.6 OUTLIER -68.32 -33.24 73.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.711 179.807 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -40.3 95.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.778 179.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -31.9 65.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.801 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -31.47 72.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.804 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 40.4 t -59.63 -26.47 65.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 40.6 t -66.63 126.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.23 176.43 7.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 3.9 t -162.59 160.28 25.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.864 179.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -146.87 85.91 0.17 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 65.49 28.26 73.4 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.481 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -106.81 94.47 5.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.804 0.335 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.99 -33.65 72.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -39.62 94.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.881 179.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 434' ' ' VAL . . . . . 0.857 HG13 HD11 ' A' ' 383' ' ' ILE . 24.5 t -76.04 -46.17 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.104 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.04 -40.32 95.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.842 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -69.32 -35.18 75.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.935 179.907 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . 0.52 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.2 -45.18 57.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.456 -179.738 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 438' ' ' ARG . . . . . 0.415 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -67.55 -40.02 84.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.884 -179.87 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.46 -44.87 85.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.026 0.441 . . . . 0.0 110.355 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -61.52 -31.6 71.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.285 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.28 -38.8 91.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.876 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 442' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 438' ' ' ARG . 26.8 t -62.64 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 443' ' ' CYS . . . . . 0.645 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.3 m -60.7 -30.01 69.68 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 444' ' ' LYS . . . . . 0.409 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.55 -41.6 98.43 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.769 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 445' ' ' ILE . . . . . 0.602 HD13 ' N ' ' A' ' 445' ' ' ILE . 0.6 OUTLIER -73.67 -35.26 43.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.508 0.671 . . . . 0.0 109.821 178.669 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . 0.645 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.4 OUTLIER -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.285 179.438 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.47 -40.45 86.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.121 179.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 448' ' ' ILE . . . . . 0.568 HG22 HG11 ' A' ' 397' ' ' VAL . 10.1 mt -72.75 -36.15 51.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.21 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -41.54 78.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.027 -179.198 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.5 -42.77 67.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -29.97 65.62 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.612 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.511 ' CG ' HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -71.32 -36.64 71.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.677 179.349 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.16 -29.86 61.4 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.41 -8.92 26.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.824 -179.809 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 452' ' ' LEU . 0.3 OUTLIER -82.52 -26.0 32.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 110.872 179.866 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -83.65 -73.57 1.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.276 -179.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.865 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 112.57 -0.212 . . . . 0.0 112.57 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.5 m -152.72 149.54 22.56 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.726 0.298 . . . . 0.0 110.926 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -69.11 -46.23 1.59 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.612 2.208 . . . . 0.0 112.274 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 55.91 172.74 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.05 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -114.22 156.92 23.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.81 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 61.9 104.73 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.432 ' HB3' ' HD2' ' A' ' 378' ' ' PRO . 59.2 Cg_exo -52.39 -174.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.65 2.233 . . . . 0.0 112.198 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.432 ' HD2' ' HB3' ' A' ' 377' ' ' PRO . 61.4 Cg_endo -80.59 -50.1 0.06 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.358 2.039 . . . . 0.0 113.289 -179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 56.3 p -74.29 -26.16 60.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.676 0.274 . . . . 0.0 111.485 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.654 HG22 HD11 ' A' ' 384' ' ' ILE . 37.7 mm -58.68 -29.75 40.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.492 ' HA ' HG12 ' A' ' 384' ' ' ILE . 30.4 mttp -56.71 -33.23 66.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.688 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.0 OUTLIER -67.18 -37.95 84.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.078 0.466 . . . . 0.0 110.773 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.44 -34.71 58.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.483 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.654 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.9 -44.68 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.316 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.31 -43.72 88.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.279 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 382' ' ' LYS . 42.5 t -70.31 -42.91 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.63 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.911 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -66.09 -35.09 79.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 179.657 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.86 -34.96 78.45 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -40.85 87.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.548 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.911 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -63.59 -35.54 73.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -40.97 98.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.513 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -70.44 -35.53 73.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.504 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.76 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.9 OUTLIER -65.22 -38.56 90.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.516 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.66 -46.88 87.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.543 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.96 -32.52 73.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.603 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -38.25 78.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.935 HG21 ' CG2' ' A' ' 448' ' ' ILE . 21.7 t -60.69 -41.98 90.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.858 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -55.63 -34.55 65.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.02 0.438 . . . . 0.0 110.468 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -84.45 -54.34 4.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.153 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.597 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.8 t80 -27.42 112.55 0.06 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.001 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.9 p -105.13 26.81 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.53 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.597 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -57.64 -170.22 0.18 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.173 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.95 143.88 48.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.217 -0.492 . . . . 0.0 111.486 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -30.56 3.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.068 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.8 t -115.48 15.77 16.68 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.485 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 0.3 OUTLIER -83.11 150.49 26.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.871 0.367 . . . . 0.0 110.859 179.887 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.534 ' O ' HD23 ' A' ' 411' ' ' LEU . 9.8 mmtm -63.41 -30.66 71.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.213 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -73.17 -38.86 66.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.967 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.535 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 16.7 t80 -60.12 -44.36 94.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.566 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.462 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -58.92 -48.82 80.1 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.653 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.587 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -64.27 -38.05 89.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.746 ' O ' HD12 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -59.58 -47.56 85.08 Favored 'General case' 0 CA--C 1.523 -0.089 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -32.64 69.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.223 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.587 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.18 -46.4 84.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.233 -179.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.717 ' SD ' HD21 ' A' ' 393' ' ' LEU . 17.3 ptp -62.85 -40.37 97.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.816 0.341 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 412' ' ' LEU . 1.3 mt -63.33 -48.15 79.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.449 . . . . 0.0 110.541 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.7 m -64.82 -30.39 71.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -62.19 -47.3 85.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.129 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.453 ' OE2' HG23 ' A' ' 390' ' ' VAL . 3.8 pt-20 -63.58 -34.81 78.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.027 0.442 . . . . 0.0 110.14 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.921 HD23 HD11 ' A' ' 423' ' ' LEU . 0.4 OUTLIER -69.01 -33.94 74.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.037 179.217 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 3.4 mp -70.34 -31.87 69.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.995 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.44 -46.38 60.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.814 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.921 HD11 HD23 ' A' ' 420' ' ' LEU . 4.5 pp -68.47 -30.82 69.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.96 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . 0.677 ' N ' HD12 ' A' ' 423' ' ' LEU . 15.6 t70 -92.68 29.74 1.7 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.217 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.3 t -109.24 -17.16 13.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.958 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 13.5 m -66.59 137.34 25.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . 0.49 ' O ' HG22 ' A' ' 428' ' ' THR . 0.3 OUTLIER -84.12 -46.75 11.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.947 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 427' ' ' GLU . 14.8 t 45.47 -167.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.358 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -169.65 -51.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.577 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.94 36.18 2.1 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.494 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.502 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.9 OUTLIER -103.84 103.27 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.906 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.5 -39.69 85.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -40.95 86.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.502 HG23 ' HB3' ' A' ' 431' ' ' GLN . 39.1 t -69.8 -46.28 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.165 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -39.33 83.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.012 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -69.15 -45.12 70.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.141 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -69.11 -37.58 78.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.291 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.856 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.0 OUTLIER -63.86 -44.55 92.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.052 -179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 34.1 tttp -67.96 -43.17 79.64 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.197 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -64.08 -39.41 94.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.1 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.59 86.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.22 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.888 HG22 HD21 ' A' ' 420' ' ' LEU . 20.3 t -62.64 -35.45 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.86 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 6.8 m -63.08 -36.05 82.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.436 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -64.39 -41.71 96.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.706 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.92 HG21 HD12 ' A' ' 420' ' ' LEU . 2.2 mp -63.36 -31.17 51.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -41.73 90.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.691 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.19 91.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.071 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.935 ' CG2' HG21 ' A' ' 397' ' ' VAL . 34.0 mt -73.61 -36.53 47.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.142 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.613 HD12 HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.5 -44.76 85.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.971 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.12 -40.93 67.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.852 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -30.93 66.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 110.067 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.545 HD11 HD12 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -77.58 -36.64 51.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.565 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -56.15 -30.0 61.55 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.805 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 10.5 pttt -90.37 -16.58 28.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.266 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -82.46 -23.5 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.668 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.57 -91.87 0.23 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.478 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.873 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.422 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 1.1 m -178.98 -61.62 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 120.632 0.253 . . . . 0.0 110.939 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . 0.422 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 57.3 Cg_endo -71.28 90.31 0.68 Allowed 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.505 2.136 . . . . 0.0 112.294 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -82.9 -33.12 26.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 62.33 90.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 1.2 p -147.11 119.01 4.71 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.745 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.404 ' HG2' HG13 ' A' ' 380' ' ' ILE . 42.0 Cg_exo -58.6 179.84 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.489 2.126 . . . . 0.0 112.298 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -89.29 -17.23 1.94 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.975 2.45 . . . . 0.0 113.358 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 19.9 m -103.6 -23.25 13.49 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.837 ' HA ' HD12 ' A' ' 383' ' ' ILE . 36.8 mm -58.65 -30.06 40.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.41 ' HA ' HG12 ' A' ' 384' ' ' ILE . 10.0 mmtp -56.8 -33.26 66.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -68.38 -39.85 81.61 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 111.218 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 1.019 HG21 ' HB1' ' A' ' 437' ' ' ALA . 4.4 mt -60.6 -31.79 49.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.673 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.72 HD11 HG22 ' A' ' 380' ' ' ILE . 0.4 OUTLIER -74.77 -44.3 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.44 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.16 178.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -56.37 -46.19 80.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.279 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.418 ' O ' HG23 ' A' ' 390' ' ' VAL . 96.6 t -68.44 -37.3 77.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.138 178.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 383' ' ' ILE . 0.2 OUTLIER -67.52 -35.19 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.256 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -62.8 -35.0 78.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.67 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -38.81 88.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.285 179.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 386' ' ' VAL . 24.2 t -69.74 -35.89 67.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.635 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -40.87 83.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.655 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -40.77 84.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.456 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.868 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -64.82 -40.99 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.498 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -59.86 -35.33 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -49.2 74.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -69.25 -45.11 70.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.99 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.902 HG11 HD11 ' A' ' 452' ' ' LEU . 23.6 t -61.38 -32.3 52.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 110.542 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -56.66 -37.05 70.26 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.239 0.543 . . . . 0.0 109.861 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -86.73 -67.7 0.8 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.671 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.896 ' CD1' HD22 ' A' ' 412' ' ' LEU . 4.0 t80 58.92 142.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.142 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.596 ' O ' HG12 ' A' ' 401' ' ' VAL . 18.0 t -123.92 20.68 4.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.093 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.528 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -115.89 178.57 17.62 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.402 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.458 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -134.19 157.03 47.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.884 0.373 . . . . 0.0 111.603 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.604 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.5 -31.71 56.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.661 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.6 t -89.77 9.48 27.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.791 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.458 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 1.8 m-20 -115.09 164.81 13.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.336 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.731 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.8 mmtm -69.66 -29.87 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.482 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -62.54 -29.23 70.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.579 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.604 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 22.9 t80 -71.64 -45.89 60.68 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.129 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.731 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.9 OUTLIER -73.14 -31.59 64.37 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.716 177.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.3 tp -67.8 -38.41 83.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.046 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.896 HD22 ' CD1' ' A' ' 400' ' ' PHE . 21.3 tp -60.85 -47.28 87.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -70.67 -32.02 69.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.795 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.57 -46.21 86.95 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.008 -179.112 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.613 ' CE ' HD12 ' A' ' 412' ' ' LEU . 8.2 ptt? -64.49 -37.56 87.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.977 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.632 HD12 ' O ' ' A' ' 416' ' ' LEU . 5.0 tp -65.95 -37.19 85.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.253 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 29.8 m -62.53 -40.35 96.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.888 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -60.52 -47.31 86.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.854 0.359 . . . . 0.0 110.489 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.717 ' OE1' HD13 ' A' ' 393' ' ' LEU . 14.7 pt-20 -72.17 -35.83 69.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.2 0.524 . . . . 0.0 109.809 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 1.044 HD12 HD12 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -61.97 -39.56 92.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.979 179.162 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.574 ' N ' HD23 ' A' ' 420' ' ' LEU . 1.7 tp -70.72 -31.79 68.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.073 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.04 -46.52 89.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.193 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.9 HD13 ' HB3' ' A' ' 441' ' ' ALA . 4.0 pp -74.45 -30.97 62.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -98.81 30.95 3.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.859 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.2 t -108.25 -16.01 14.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 5.6 m -66.53 127.34 27.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.864 0.364 . . . . 0.0 111.123 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -84.79 -41.73 15.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.9 p 55.89 -174.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.021 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -178.05 50.64 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.22 -28.92 4.21 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.454 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.757 ' HG2' HG23 ' A' ' 434' ' ' VAL . 0.3 OUTLIER -60.17 92.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.31 -35.61 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 20.5 p -61.81 -38.71 89.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.757 HG23 ' HG2' ' A' ' 431' ' ' GLN . 31.0 t -76.07 -36.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.056 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -40.99 94.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.88 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -69.22 -36.69 77.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 1.019 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.21 -45.1 58.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.417 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 439' ' ' LYS . 0.0 OUTLIER -65.17 -39.77 93.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.936 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 438' ' ' ARG . 0.0 OUTLIER -63.99 -43.42 95.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.601 179.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -32.31 71.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.696 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.9 ' HB3' HD13 ' A' ' 423' ' ' LEU . . . -66.9 -45.45 77.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.194 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.617 ' HA ' HD11 ' A' ' 445' ' ' ILE . 23.2 t -62.89 -30.78 50.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.111 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 4.0 t -67.35 -40.64 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.917 0.389 . . . . 0.0 110.48 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -44.73 78.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.087 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 1.044 HD12 HD12 ' A' ' 420' ' ' LEU . 9.4 pt -65.35 -31.23 52.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.916 0.388 . . . . 0.0 110.873 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.18 -47.78 84.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.725 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.67 80.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.819 HD12 ' HA ' ' A' ' 445' ' ' ILE . 21.4 mt -66.88 -36.6 77.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.718 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.45 -51.52 69.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.675 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -61.93 -30.47 70.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 110.336 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.39 75.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.075 0.464 . . . . 0.0 109.992 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.902 HD11 HG11 ' A' ' 397' ' ' VAL . 4.9 mp -70.81 -36.8 73.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.287 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -56.16 -29.84 61.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.187 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -101.19 -16.57 16.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.544 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -22.23 35.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.709 0.29 . . . . 0.0 110.95 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.36 -86.39 0.61 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.381 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.881 179.943 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.449 -0.261 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 90.7 p -82.52 144.48 49.43 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.669 0.271 . . . . 0.0 110.879 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -82.19 51.39 3.77 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.732 2.288 . . . . 0.0 112.58 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 52.2 39.94 27.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.866 0.365 . . . . 0.0 111.105 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 63.27 -79.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.889 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.94 113.63 57.78 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.742 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.438 ' HB2' HG12 ' A' ' 380' ' ' ILE . 76.2 Cg_exo -49.98 170.12 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.542 2.162 . . . . 0.0 112.47 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.88 -52.21 1.36 Allowed 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.916 2.411 . . . . 0.0 113.231 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.7 p -74.32 -27.29 60.63 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.9 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.8 mm -58.65 -29.76 40.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 2.1 mmpt? -56.71 -32.97 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.103 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -66.1 -41.98 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.941 0.401 . . . . 0.0 111.529 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.9 HG22 ' O ' ' A' ' 380' ' ' ILE . 7.8 tp -60.57 -31.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.547 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.693 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -74.91 -44.82 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.696 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -58.56 -49.35 77.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.809 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.452 HG13 ' N ' ' A' ' 387' ' ' LEU . 11.9 p -64.1 -42.89 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.452 ' N ' HG13 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -65.56 -33.5 76.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.681 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.87 -34.82 78.18 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.947 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.15 -43.38 87.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.487 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.71 HG13 ' OE2' ' A' ' 419' ' ' GLU . 28.0 t -61.97 -35.97 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.853 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.01 -41.07 97.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.808 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -68.27 -42.2 79.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.77 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.81 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.3 mm? -61.26 -38.22 85.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.717 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -60.38 -45.64 92.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.724 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -60.94 -35.68 77.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.808 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -69.34 -39.93 77.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.006 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 393' ' ' LEU . 9.0 t -60.62 -39.71 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.842 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -40.31 72.04 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.435 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -76.88 -54.27 6.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.101 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.689 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 39.5 t80 -24.3 113.11 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.051 -0.977 . . . . 0.0 113.222 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.616 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.5 p -104.71 28.11 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.351 178.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.689 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -50.58 -179.96 0.03 OUTLIER Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.87 -0.605 . . . . 0.0 113.411 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.88 143.51 48.33 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.708 -0.746 . . . . 0.0 111.636 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -20.46 43.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.493 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.2 m -101.87 -14.33 17.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.751 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.5 ' OD2' ' HB3' ' A' ' 408' ' ' ALA . 23.7 t70 -77.47 151.44 34.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.786 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.9 OUTLIER -71.29 -32.02 68.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 179.788 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.5 ' HB3' ' OD2' ' A' ' 406' ' ' ASP . . . -62.89 -29.1 70.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.342 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.529 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 29.8 t80 -64.23 -45.4 88.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.797 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.786 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.3 p-90 -72.82 -27.84 62.2 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 118.826 -1.149 . . . . 0.0 108.677 177.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.568 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.3 mp -67.59 -41.37 84.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.521 177.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 1.019 HD12 HD11 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.35 -47.21 86.91 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.285 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.545 ' HG2' HD23 ' A' ' 449' ' ' LEU . 11.3 mt-10 -70.49 -32.37 69.85 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.483 177.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.83 -43.42 96.25 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.721 -179.676 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.739 ' CE ' HD11 ' A' ' 393' ' ' LEU . 18.7 ttt -69.66 -41.37 75.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.266 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.626 ' O ' HD13 ' A' ' 416' ' ' LEU . 0.4 OUTLIER -66.04 -37.21 85.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.721 179.637 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.435 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 85.0 m -67.71 -30.31 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.91 -38.4 72.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.441 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.71 ' OE2' HG13 ' A' ' 390' ' ' VAL . 5.4 pt-20 -70.78 -37.95 73.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.556 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.854 HD12 ' N ' ' A' ' 421' ' ' LEU . 4.2 pp -72.97 -33.32 65.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 110.851 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.854 ' N ' HD12 ' A' ' 420' ' ' LEU . 1.1 tp -68.49 -32.24 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -71.1 -39.48 72.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.793 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.691 HD13 ' HB1' ' A' ' 441' ' ' ALA . 3.0 mt -58.56 -31.74 68.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.833 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.13 -25.04 17.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.082 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 38.3 t -55.44 -31.02 61.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.023 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 7.6 m -74.68 120.87 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.109 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -88.4 143.15 27.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.411 HG21 ' CG1' ' A' ' 434' ' ' VAL . 27.1 p -131.23 -170.51 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.883 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -147.86 -90.58 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.516 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -96.45 29.76 9.79 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 89.82 4.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -40.05 96.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.809 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.3 t -60.0 -41.03 91.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.827 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.411 ' CG1' HG21 ' A' ' 428' ' ' THR . 32.1 t -71.4 -35.61 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.978 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . 0.434 ' HA ' ' HD3' ' A' ' 438' ' ' ARG . 0.1 OUTLIER -64.5 -43.54 93.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.716 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . 0.402 ' HA ' ' HG2' ' A' ' 439' ' ' LYS . 2.8 tt0 -69.19 -32.85 72.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.871 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.33 -45.13 61.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.863 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.434 ' HD3' ' HA ' ' A' ' 435' ' ' ARG . 14.5 ptm180 -64.12 -44.55 91.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.572 0.225 . . . . 0.0 111.333 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . 0.436 ' HG3' ' N ' ' A' ' 440' ' ' GLU . 1.5 pttt -63.72 -32.87 74.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.903 0.382 . . . . 0.0 110.576 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 4.7 mm-40 -67.75 -31.24 71.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.533 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.691 ' HB1' HD13 ' A' ' 423' ' ' LEU . . . -70.59 -40.2 73.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.798 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.561 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 21.2 t -62.86 -34.13 64.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 66.0 m -70.7 -43.52 68.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.732 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.87 -44.75 69.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.009 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.776 HD13 HD22 ' A' ' 420' ' ' LEU . 2.3 pp -63.89 -31.13 51.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.107 0.48 . . . . 0.0 110.697 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -39.88 90.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.341 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.56 81.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.055 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.801 ' CG2' HG21 ' A' ' 397' ' ' VAL . 19.3 mt -72.67 -38.33 58.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.545 HD23 ' HG2' ' A' ' 413' ' ' GLU . 3.5 mt -57.76 -48.52 79.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -70.18 -37.17 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.638 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.89 -31.27 66.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.082 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 1.019 HD11 HD12 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -76.23 -36.74 58.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.444 179.351 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.74 -29.91 65.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.602 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.11 -13.46 28.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.248 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.415 ' CE ' HG12 ' A' ' 397' ' ' VAL . 0.0 OUTLIER -82.42 -24.24 34.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.809 0.338 . . . . 0.0 110.6 179.82 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -79.11 -80.61 0.75 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.368 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.255 -0.878 . . . . 0.0 110.862 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 14.9 m -108.01 135.33 19.88 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.515 0.198 . . . . 0.0 110.87 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.66 130.22 12.43 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.508 2.139 . . . . 0.0 112.393 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -112.8 94.22 4.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.763 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -97.46 -41.44 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.084 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.828 HG21 HG13 ' A' ' 384' ' ' ILE . 0.6 OUTLIER -140.67 170.6 9.18 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.057 -179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.483 ' HB2' ' HB ' ' A' ' 380' ' ' ILE . 35.0 Cg_exo -60.6 174.98 1.34 Allowed 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.703 2.268 . . . . 0.0 111.932 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.481 ' HD2' ' HB3' ' A' ' 377' ' ' PRO . 6.2 Cg_endo -48.29 -77.29 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.874 2.383 . . . . 0.0 113.274 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 11.4 m -96.55 -18.14 20.0 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.916 ' O ' HG22 ' A' ' 383' ' ' ILE . 27.4 mm -58.85 -30.09 41.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.229 0.538 . . . . 0.0 109.691 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 20.2 pttt -56.66 -33.01 65.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.932 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.648 ' O ' HG23 ' A' ' 386' ' ' VAL . 32.4 mttt -65.07 -42.96 93.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.589 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.916 HG22 ' O ' ' A' ' 380' ' ' ILE . 0.8 OUTLIER -60.57 -32.04 50.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.828 HG13 HG21 ' A' ' 376' ' ' THR . 0.3 OUTLIER -74.88 -44.76 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.545 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -56.69 -47.31 80.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.692 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 382' ' ' LYS . 37.2 t -65.43 -34.5 70.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.669 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.44 82.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.49 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 0.6 OUTLIER -62.73 -34.64 77.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.581 178.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . 0.803 ' O ' HD23 ' A' ' 393' ' ' LEU . 0.0 OUTLIER -70.16 -34.67 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.438 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 386' ' ' VAL . 28.2 t -67.08 -46.76 83.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 13.5 pt20 -60.36 -40.93 92.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -68.52 -38.77 81.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.302 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.84 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.6 mm? -64.91 -37.9 89.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.323 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . 0.407 ' HB2' HD11 ' A' ' 448' ' ' ILE . 4.5 tt0 -58.86 -44.0 90.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.457 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.5 -39.64 88.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.694 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -69.24 -40.05 78.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.908 HG21 HG21 ' A' ' 448' ' ' ILE . 23.7 t -60.63 -36.98 74.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.68 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -38.31 70.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.203 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.501 ' O ' ' C ' ' A' ' 400' ' ' PHE . 18.2 tt0 -79.84 -55.46 4.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.043 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.648 ' CE1' HD23 ' A' ' 412' ' ' LEU . 20.4 t80 -4.71 109.12 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.404 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 23.3 m -101.47 25.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.692 178.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.602 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -67.36 -173.59 6.53 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.843 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.0 143.74 48.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.305 -0.447 . . . . 0.0 111.496 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.455 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -57.27 -24.3 53.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.903 179.147 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . 0.425 HG22 ' O ' ' A' ' 405' ' ' THR . 7.6 m -103.84 13.33 33.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.204 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.71 149.24 28.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.791 0.329 . . . . 0.0 110.687 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.782 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.16 -30.09 70.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.97 0.414 . . . . 0.0 110.9 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.78 -29.15 70.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.012 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 3.0 t80 -68.01 -45.56 73.68 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.782 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.13 63.84 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.691 177.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.577 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -66.44 -40.05 89.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.423 177.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -60.83 -47.25 87.21 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.544 ' HA ' HD21 ' A' ' 416' ' ' LEU . 0.9 OUTLIER -70.73 -32.27 69.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.729 177.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.85 -45.26 90.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.636 -179.165 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.502 ' HA ' ' HG2' ' A' ' 418' ' ' LYS . 21.4 ptp -66.45 -44.79 81.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.748 0.309 . . . . 0.0 111.136 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.676 HD12 ' N ' ' A' ' 417' ' ' THR . 4.1 pp -69.26 -37.13 77.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.831 0.348 . . . . 0.0 111.073 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.676 ' N ' HD12 ' A' ' 416' ' ' LEU . 98.5 m -73.61 -44.03 58.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.679 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -58.01 -37.96 75.25 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.599 -179.627 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.498 ' OE2' HG22 ' A' ' 390' ' ' VAL . 19.0 pt-20 -72.27 -34.8 68.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.206 0.527 . . . . 0.0 109.651 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.86 ' HA ' HD12 ' A' ' 423' ' ' LEU . 15.5 tp -65.98 -44.13 85.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.446 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.63 -34.07 75.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.78 -39.46 94.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.433 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.86 HD12 ' HA ' ' A' ' 420' ' ' LEU . 6.7 mt -60.21 -35.17 74.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.789 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.24 -28.85 57.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.061 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.3 m -57.01 -34.87 68.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.962 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.06 120.15 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.0 158.13 8.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.992 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.446 ' HA ' HG21 ' A' ' 434' ' ' VAL . 72.3 p -122.71 -72.69 0.67 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 71.9 -100.47 0.93 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.551 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -118.71 72.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.479 ' HB3' HG22 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -160.21 108.8 1.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.902 0.382 . . . . 0.0 110.823 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.57 -28.63 67.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.397 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.8 m -57.54 -44.97 85.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.685 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.479 HG22 ' HB3' ' A' ' 431' ' ' GLN . 17.2 m -76.11 -35.48 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.147 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -44.43 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.872 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -35.8 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.777 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.96 -32.13 65.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.99 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.537 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -72.72 -42.45 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.354 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 -36.64 84.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.567 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -42.57 99.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.81 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.523 ' CB ' HD13 ' A' ' 423' ' ' LEU . . . -62.07 -45.57 92.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.915 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.573 HG22 HD11 ' A' ' 420' ' ' LEU . 22.2 t -63.96 -31.64 54.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.909 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 97.9 m -70.7 -46.78 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.924 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -44.76 76.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.763 HG12 HD13 ' A' ' 420' ' ' LEU . 2.4 pp -64.14 -31.13 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.792 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -46.58 88.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.152 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -63.08 -36.03 82.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.684 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.908 HG21 HG21 ' A' ' 397' ' ' VAL . 17.6 mt -73.14 -36.54 50.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.806 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.49 -49.26 76.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.702 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -41.87 66.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.416 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.9 mmtp -57.88 -30.01 65.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.083 0.468 . . . . 0.0 110.007 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.462 HD12 HG13 ' A' ' 397' ' ' VAL . 1.8 tp -76.72 -36.72 56.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.438 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -56.98 -29.9 63.65 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -96.52 -11.16 25.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.477 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.56 -24.69 33.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -94.66 -71.34 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.416 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.401 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.935 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 112.524 -0.23 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 22.4 t -63.22 111.07 4.3 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.537 0.208 . . . . 0.0 110.903 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.23 111.35 3.06 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.468 2.112 . . . . 0.0 112.253 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -119.4 131.75 55.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.946 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 60.81 173.86 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.896 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 1.6 p -145.13 151.26 47.92 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.942 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.639 ' HD2' HD12 ' A' ' 380' ' ' ILE . 58.4 Cg_exo -53.19 -175.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.646 2.23 . . . . 0.0 112.409 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.415 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 73.2 Cg_endo -88.63 -9.19 4.92 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.798 2.332 . . . . 0.0 113.555 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.65 -25.96 8.86 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.746 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.654 HG22 HD11 ' A' ' 384' ' ' ILE . 3.2 mt -58.71 -29.77 40.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -56.8 -33.17 66.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.978 -179.815 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -67.48 -38.03 83.77 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.135 0.493 . . . . 0.0 110.745 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 40.8 mm -60.44 -33.58 54.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.63 178.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.654 HD11 HG22 ' A' ' 380' ' ' ILE . 0.4 OUTLIER -74.74 -44.41 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.411 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -56.57 -45.12 81.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 382' ' ' LYS . 57.8 t -66.13 -39.63 84.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.162 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.681 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.4 OUTLIER -67.58 -32.57 73.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.292 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -35.14 79.18 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -38.06 74.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.184 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.681 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.9 p -70.38 -37.7 71.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.582 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -66.9 -40.97 87.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.841 0.353 . . . . 0.0 110.624 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -40.75 75.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.468 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.898 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.7 OUTLIER -62.04 -38.65 89.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.426 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -59.63 -47.32 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.676 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -36.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.659 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -69.32 -37.5 77.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.096 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 393' ' ' LEU . 25.6 t -60.53 -45.64 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.218 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -55.49 -31.92 62.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.915 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -87.4 -54.39 4.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.52 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.799 ' CE2' HD22 ' A' ' 412' ' ' LEU . 4.1 t80 -48.11 113.54 0.76 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.741 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.468 ' O ' ' O ' ' A' ' 402' ' ' GLY . 28.7 m -47.68 -31.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.881 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.689 ' HA2' ' CZ ' ' A' ' 400' ' ' PHE . . . 37.4 106.7 0.01 OUTLIER Glycine 0 C--O 1.228 -0.264 0 N-CA-C 114.679 0.632 . . . . 0.0 114.679 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.25 143.0 48.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.039 0.447 . . . . 0.0 110.893 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.487 ' HG2' ' CB ' ' A' ' 457' ' ' LEU . 0.2 OUTLIER -60.09 -22.18 62.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.217 179.764 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.99 1.1 51.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.35 135.64 53.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.917 0.389 . . . . 0.0 110.564 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.706 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 10.9 mtmt -61.01 -29.87 69.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.641 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 412' ' ' LEU . . . -62.71 -28.97 70.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.054 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 38.5 t80 -67.23 -45.85 75.55 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.706 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -73.05 -30.27 63.59 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 118.824 -1.15 . . . . 0.0 108.934 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.579 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.0 tp -69.63 -38.45 77.22 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.743 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 1.044 HD23 HD11 ' A' ' 452' ' ' LEU . 0.3 OUTLIER -62.31 -47.16 85.49 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.259 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -70.64 -32.81 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.408 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.1 mt-10 -64.1 -43.6 94.85 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.824 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 39.2 ttm -69.59 -35.26 75.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.659 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . . . . . . . . . 11.3 tp -63.41 -48.08 79.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.818 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 52.7 m -65.01 -30.46 71.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.066 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -47.34 85.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.259 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.45 ' OE2' HG23 ' A' ' 390' ' ' VAL . 2.9 pt-20 -67.21 -36.16 81.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.577 HD13 ' C ' ' A' ' 420' ' ' LEU . 3.1 tm? -67.74 -34.64 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.001 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.22 -31.9 69.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -43.0 98.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.772 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 438' ' ' ARG . 0.2 OUTLIER -54.79 -31.15 58.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.014 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -76.64 -14.19 60.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 5.8 m -84.58 -25.79 28.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.768 0.318 . . . . 0.0 111.143 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.6 137.73 24.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.167 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.9 164.55 25.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.541 HG21 HH11 ' A' ' 438' ' ' ARG . 2.0 t -178.48 126.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.71 -84.97 1.78 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.439 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -134.89 38.09 1.86 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.473 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.559 ' HB3' HG22 ' A' ' 434' ' ' VAL . 0.5 OUTLIER -91.77 123.82 35.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 110.892 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -67.69 -28.65 67.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.076 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 8.6 t -67.17 -44.85 78.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.675 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.559 HG22 ' HB3' ' A' ' 431' ' ' GLN . 21.4 m -75.47 -37.59 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.733 0.301 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 40.1 mtt180 -67.66 -44.65 77.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.911 0.386 . . . . 0.0 110.697 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -69.41 -34.46 74.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.94 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.24 -45.22 57.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.513 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.541 HH11 HG21 ' A' ' 428' ' ' THR . 0.9 OUTLIER -65.06 -39.12 92.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.781 0.324 . . . . 0.0 110.884 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -35.21 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.529 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.38 -35.89 80.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.441 ' CB ' HD13 ' A' ' 423' ' ' LEU . . . -62.09 -45.43 93.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.548 HG22 HD21 ' A' ' 420' ' ' LEU . 24.3 t -62.96 -33.29 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.752 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.2 m -70.73 -45.23 65.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.506 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -44.65 77.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.062 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.618 HD12 ' N ' ' A' ' 446' ' ' GLN . 2.8 pp -63.37 -31.03 51.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.06 0.457 . . . . 0.0 110.799 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.618 ' N ' HD12 ' A' ' 445' ' ' ILE . 5.6 tp-100 -65.1 -41.54 94.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.508 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.49 -40.2 92.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.401 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.6 mt -67.7 -36.66 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -46.99 83.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.698 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -40.58 68.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.536 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -30.6 66.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.025 0.44 . . . . 0.0 109.967 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 1.044 HD11 HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -77.59 -36.76 51.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.264 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.5 -29.94 69.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.629 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -86.64 -18.8 30.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.427 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 402' ' ' GLY . 0.0 OUTLIER -82.25 -25.93 33.65 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.828 ' O ' HD12 ' A' ' 457' ' ' LEU . . . -130.42 -115.96 1.8 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.828 HD12 ' O ' ' A' ' 456' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.03 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.174 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.41 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 0.3 OUTLIER -178.5 -61.78 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.626 0.251 . . . . 0.0 110.93 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 56.6 Cg_endo -70.62 149.45 61.39 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.466 2.111 . . . . 0.0 112.289 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -159.54 -51.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.001 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -132.58 96.15 3.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.09 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.2 123.97 67.51 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.737 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.628 ' HG2' HG13 ' A' ' 380' ' ' ILE . 52.7 Cg_exo -56.85 172.53 0.73 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.563 2.175 . . . . 0.0 112.394 -179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -77.85 -54.8 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.056 2.504 . . . . 0.0 113.597 -178.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 66.0 m -85.98 -22.66 27.23 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.686 HG22 HD11 ' A' ' 384' ' ' ILE . 43.8 mm -58.63 -29.77 40.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.474 ' HA ' HG12 ' A' ' 384' ' ' ILE . 27.3 mtmm -56.92 -33.16 66.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.06 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -67.92 -37.97 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.133 0.492 . . . . 0.0 110.694 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.877 HG21 ' HB1' ' A' ' 437' ' ' ALA . 37.5 mt -60.55 -33.6 55.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.41 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.686 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.77 -44.65 45.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.237 178.477 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -49.38 77.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.669 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.724 HG21 ' HB3' ' A' ' 423' ' ' LEU . 14.5 p -65.47 -45.02 94.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.494 ' N ' HG13 ' A' ' 386' ' ' VAL . 5.3 tt -63.38 -33.41 75.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.8 -35.05 78.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.741 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.38 -40.26 93.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.286 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.86 HG22 ' OE2' ' A' ' 419' ' ' GLU . 24.6 t -64.35 -37.01 78.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 -41.15 89.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -63.42 -38.52 91.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.455 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.802 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -63.77 -38.03 89.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 179.544 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.93 -42.79 90.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.639 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.95 -40.3 92.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -69.12 -45.26 70.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.777 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 393' ' ' LEU . 23.1 t -60.65 -36.91 73.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.705 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -58.42 -40.36 82.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.101 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -84.16 -67.55 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.809 ' CD1' HD22 ' A' ' 412' ' ' LEU . 18.6 t80 21.96 107.83 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 401' ' ' VAL . 20.4 t -95.79 25.93 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.065 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.583 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -84.88 -176.8 50.95 Favored Glycine 0 N--CA 1.441 -0.99 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.732 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.25 143.81 48.02 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.404 -0.398 . . . . 0.0 111.628 -179.73 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.492 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -58.6 -23.52 58.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.82 0.343 . . . . 0.0 110.867 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . 0.414 HG22 ' HD2' ' A' ' 404' ' ' LYS . 16.1 p -101.99 12.96 36.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.104 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.64 153.5 26.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.8 0.334 . . . . 0.0 110.873 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.819 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 1.2 mttt -61.15 -30.1 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.899 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.73 -29.19 70.49 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.508 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.492 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 3.7 t80 -72.06 -45.67 59.86 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.819 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -73.07 -29.36 62.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 118.841 -1.144 . . . . 0.0 108.9 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 15.8 tp -69.68 -41.32 75.61 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.428 178.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.809 HD22 ' CD1' ' A' ' 400' ' ' PHE . 8.0 tp -61.07 -46.71 89.56 Favored 'General case' 0 C--N 1.34 0.168 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.454 ' HG2' HD11 ' A' ' 416' ' ' LEU . 1.1 tt0 -70.2 -32.16 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.602 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.5 OUTLIER -63.9 -37.78 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.83 -179.652 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 5.9 ttt -69.75 -44.57 69.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.173 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.847 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -68.88 -37.01 78.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.791 0.329 . . . . 0.0 110.843 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.847 ' N ' HD12 ' A' ' 416' ' ' LEU . 90.4 m -62.58 -33.57 75.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.493 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -66.35 -47.46 73.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.138 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.86 ' OE2' HG22 ' A' ' 390' ' ' VAL . 0.3 OUTLIER -69.77 -34.7 74.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.82 HD12 ' CG2' ' A' ' 445' ' ' ILE . 6.2 tt -59.6 -44.42 93.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.864 178.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' A' ' 421' ' ' LEU . 1.7 tp -70.51 -31.82 69.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.354 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.67 -46.88 87.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.427 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.777 HD21 HD11 ' A' ' 445' ' ' ILE . 1.7 pp -74.55 -31.06 61.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.797 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.78 -19.46 61.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.116 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 35.5 t -95.3 35.38 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.197 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . 0.449 HG13 ' O ' ' A' ' 423' ' ' LEU . 34.1 m -97.78 131.92 43.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -91.85 128.15 37.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 8.1 t -113.94 145.31 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.92 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.29 66.46 0.55 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.439 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.35 74.49 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.495 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.468 ' OE1' HG21 ' A' ' 434' ' ' VAL . 86.1 mt-30 -97.22 114.03 25.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 0.0 110.844 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.79 -31.58 72.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 18.5 t -63.48 -44.42 94.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.468 HG21 ' OE1' ' A' ' 431' ' ' GLN . 21.8 t -68.47 -38.94 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.116 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -44.61 96.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.884 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -69.23 -35.64 76.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.851 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.877 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.19 -37.02 66.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.181 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.73 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.3 OUTLIER -72.7 -44.69 61.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 -179.809 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -34.09 75.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.879 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.13 -41.76 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -63.75 -45.73 88.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.339 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 438' ' ' ARG . 34.0 t -63.82 -32.81 58.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.873 0.368 . . . . 0.0 110.854 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.88 -43.57 98.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.588 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.21 -37.78 88.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.82 ' CG2' HD12 ' A' ' 420' ' ' LEU . 14.7 mt -63.26 -33.21 59.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.106 0.479 . . . . 0.0 110.575 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.22 -47.72 83.19 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.752 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.58 70.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.862 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.788 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.6 mt -62.52 -37.07 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.643 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -52.93 63.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.647 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -39.53 86.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.525 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.4 ttpp -57.89 -30.12 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.209 0.528 . . . . 0.0 109.729 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' A' ' 400' ' ' PHE . 36.4 tp -72.82 -36.43 67.53 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.416 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.91 -29.9 60.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.221 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.36 -22.8 32.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.198 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.37 -21.89 35.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -69.07 -99.98 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.401 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.2 mp . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.923 179.968 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 112.53 -0.228 . . . . 0.0 112.53 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 34.3 m -90.8 115.67 64.75 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.505 0.193 . . . . 0.0 110.911 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -67.33 -177.21 1.03 Allowed 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.408 2.072 . . . . 0.0 112.265 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 63.62 125.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -88.02 142.5 27.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 13.1 p -141.45 77.81 19.23 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.859 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.427 ' HG2' HG13 ' A' ' 380' ' ' ILE . 74.9 Cg_exo -51.46 -177.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.67 2.246 . . . . 0.0 112.626 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.89 -67.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.993 2.462 . . . . 0.0 113.097 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 24.0 m -63.9 -24.18 67.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.735 ' HA ' HD12 ' A' ' 383' ' ' ILE . 31.3 mm -58.71 -29.87 40.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.461 ' HA ' HG12 ' A' ' 384' ' ' ILE . 15.2 mtmt -56.96 -33.26 66.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.82 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.455 ' O ' HG12 ' A' ' 386' ' ' VAL . 4.1 mttt -67.62 -38.02 83.33 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.128 0.489 . . . . 0.0 110.763 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.738 HG21 ' HB1' ' A' ' 437' ' ' ALA . 24.8 mt -60.48 -34.01 56.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.449 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.643 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.66 -44.78 46.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.204 178.445 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -48.53 81.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.468 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.497 HG13 ' N ' ' A' ' 387' ' ' LEU . 14.5 p -67.45 -45.88 84.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.497 ' N ' HG13 ' A' ' 386' ' ' VAL . 6.5 tt -64.59 -33.62 76.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.378 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -62.68 -35.06 78.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.704 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -39.18 91.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.1 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.867 HG13 ' OE2' ' A' ' 419' ' ' GLU . 40.5 t -66.81 -36.03 76.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.413 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -40.97 85.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.582 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -48.0 76.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.47 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.811 HD22 HD23 ' A' ' 416' ' ' LEU . 4.9 tt -60.88 -38.09 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.406 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -39.32 83.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.379 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -61.48 -40.51 94.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.427 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -68.11 -40.89 82.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.638 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.728 HG23 ' O ' ' A' ' 393' ' ' LEU . 22.0 t -60.67 -30.5 47.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.693 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -61.99 -36.82 82.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.188 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -87.48 -67.75 0.8 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.215 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.951 ' CD1' HD22 ' A' ' 412' ' ' LEU . 5.5 t80 56.13 159.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.423 0.63 . . . . 0.0 111.915 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 13.5 m -142.26 20.49 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.056 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.563 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -108.18 -172.68 21.7 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.799 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.442 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.08 144.53 48.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.718 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.554 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.77 -28.6 15.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.124 179.238 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 2.7 t -102.68 15.89 28.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -115.44 157.69 23.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.92 0.39 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.831 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.8 tmtt? -61.18 -30.09 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.963 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.85 -29.13 70.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.632 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.554 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 11.0 t80 -75.18 -45.9 37.64 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.831 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -73.1 -31.99 64.69 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.68 -1.208 . . . . 0.0 108.61 177.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.607 HD11 ' CE ' ' A' ' 415' ' ' MET . 38.7 tp -65.67 -41.11 92.84 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.093 177.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.956 HD23 HD21 ' A' ' 452' ' ' LEU . 30.4 tp -59.66 -46.73 88.14 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.18 -31.72 69.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.773 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.9 tm-20 -63.28 -43.39 98.04 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.983 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.607 ' CE ' HD11 ' A' ' 411' ' ' LEU . 9.7 mmt -67.06 -40.18 87.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 109.664 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.811 HD23 HD22 ' A' ' 393' ' ' LEU . 1.2 tm? -61.11 -37.36 82.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.645 179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 3.6 m -62.84 -42.18 99.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.884 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -47.22 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.844 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.867 ' OE2' HG13 ' A' ' 390' ' ' VAL . 3.9 pt-20 -70.85 -34.78 72.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.372 . . . . 0.0 110.125 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 1.042 HD11 HD13 ' A' ' 445' ' ' ILE . 1.2 tt -61.61 -45.1 95.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.122 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 421' ' ' LEU . 3.4 tp -70.21 -31.88 69.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.785 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -58.9 -46.29 88.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.837 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 419' ' ' GLU . 1.2 mt -59.54 -31.42 69.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.806 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -100.47 29.18 4.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.913 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 57.6 m -107.96 -29.22 9.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 15.0 m -66.54 133.5 31.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.08 166.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.498 ' HB ' HG11 ' A' ' 434' ' ' VAL . 1.8 t -156.67 -45.84 0.07 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.914 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 75.01 -69.28 1.9 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.444 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -164.5 40.71 0.3 Allowed Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.425 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -96.38 119.56 35.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -63.11 -31.45 72.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.859 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.7 m -67.65 -42.38 82.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.939 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.498 HG11 ' HB ' ' A' ' 428' ' ' THR . 26.2 t -73.44 -43.46 55.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 438' ' ' ARG . 4.7 mtt180 -59.21 -40.64 86.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.752 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -69.4 -34.58 74.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.892 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.738 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -71.77 -45.34 61.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.634 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 435' ' ' ARG . 0.2 OUTLIER -66.33 -35.06 79.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.389 . . . . 0.0 110.602 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -34.25 77.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -67.33 -37.0 82.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.76 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.478 ' HB1' HD13 ' A' ' 423' ' ' LEU . . . -61.95 -45.53 93.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.058 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.543 ' HA ' ' CG1' ' A' ' 445' ' ' ILE . 31.5 t -63.32 -32.76 57.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.788 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -46.79 62.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.023 0.44 . . . . 0.0 110.815 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.73 88.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.046 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 1.042 HD13 HD11 ' A' ' 420' ' ' LEU . 1.9 pp -63.37 -31.15 51.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.99 0.424 . . . . 0.0 110.609 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.32 -47.7 84.89 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.837 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.74 -35.85 79.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.466 HD12 ' HA ' ' A' ' 445' ' ' ILE . 41.6 mt -70.16 -36.4 67.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.861 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -48.33 79.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.72 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -39.71 91.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.24 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -57.77 -30.1 65.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.166 0.508 . . . . 0.0 109.692 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.956 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -72.08 -37.28 69.64 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.378 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -58.07 -29.91 65.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.63 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . 0.402 ' O ' HD13 ' A' ' 457' ' ' LEU . 7.8 mtmt -91.01 -15.07 30.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.485 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -24.41 34.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.884 0.373 . . . . 0.0 110.583 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.32 -86.58 0.35 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.262 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 454' ' ' LYS . 3.8 mp . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.774 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 112.462 -0.255 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.421 ' N ' ' HD2' ' A' ' 373' ' ' PRO . 2.4 t -178.6 -61.67 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.597 0.237 . . . . 0.0 110.94 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 372' ' ' SER . 37.2 Cg_endo -65.75 109.81 1.53 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.396 2.064 . . . . 0.0 112.32 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -135.1 50.34 2.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.739 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 61.46 153.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.847 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.29 156.75 63.07 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.952 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.635 ' HG2' ' HB ' ' A' ' 380' ' ' ILE . 95.0 Cg_endo -80.81 167.78 18.17 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.794 2.329 . . . . 0.0 112.295 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -96.77 -9.74 0.79 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.197 2.598 . . . . 0.0 114.135 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.41 -28.33 3.96 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.635 ' HB ' ' HG2' ' A' ' 377' ' ' PRO . 24.8 mm -58.62 -29.38 39.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.458 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.55 -33.31 66.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.008 -179.715 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -68.24 -38.09 81.48 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.224 0.535 . . . . 0.0 110.65 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.748 HD11 HG13 ' A' ' 434' ' ' VAL . 47.7 mt -60.49 -33.97 56.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.531 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.59 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.78 -44.63 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.348 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -56.8 -48.44 77.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.323 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.749 HG21 ' HG ' ' A' ' 423' ' ' LEU . 13.5 p -66.41 -36.3 77.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.652 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.34 -35.93 80.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.43 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.79 -34.95 78.33 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -34.65 72.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.54 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 386' ' ' VAL . 21.4 t -70.4 -46.17 71.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.283 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -58.32 -38.8 77.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.683 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.78 -43.42 98.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.383 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.895 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -59.78 -38.55 82.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.47 179.531 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . 0.426 ' HG3' HD11 ' A' ' 448' ' ' ILE . 0.2 OUTLIER -59.01 -39.88 83.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.602 179.751 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -45.39 92.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.637 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -69.29 -44.26 72.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.76 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 393' ' ' LEU . 28.0 t -60.61 -31.38 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.507 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -60.38 -36.37 77.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.206 0.527 . . . . 0.0 109.928 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.48 ' O ' ' O ' ' A' ' 400' ' ' PHE . 5.2 tt0 -90.73 -69.03 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.926 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.776 ' CD1' HD22 ' A' ' 412' ' ' LEU . 10.2 t80 36.47 109.0 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.118 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 27.8 m -94.81 25.44 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.107 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.528 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.07 -174.46 43.83 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.707 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.81 143.61 48.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.574 -0.313 . . . . 0.0 111.413 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.531 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -56.69 -23.71 44.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.549 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.68 10.15 36.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.308 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.47 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 0.1 OUTLIER -101.93 150.58 23.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.841 0.353 . . . . 0.0 110.474 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.794 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 pptp? -61.13 -30.2 70.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.85 -29.23 70.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.24 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.531 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.6 t80 -69.69 -45.6 67.91 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.794 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 5.5 p-90 -72.87 -30.53 64.05 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.902 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.608 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 26.0 tp -69.69 -38.43 77.01 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.418 177.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.776 HD22 ' CD1' ' A' ' 400' ' ' PHE . 9.7 tp -61.53 -47.19 86.72 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.662 ' HG3' HD13 ' A' ' 452' ' ' LEU . 2.0 mt-10 -70.5 -32.52 70.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.483 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.608 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mm-40 -65.51 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.001 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.67 -44.49 70.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.025 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.769 HD12 ' N ' ' A' ' 417' ' ' THR . 4.3 pp -68.86 -37.05 78.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.782 0.325 . . . . 0.0 110.734 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.769 ' N ' HD12 ' A' ' 416' ' ' LEU . 59.7 m -64.15 -38.97 92.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.621 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -47.28 86.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.459 ' CD ' HD12 ' A' ' 393' ' ' LEU . 14.8 pt-20 -68.53 -34.75 76.42 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.929 ' HB2' HD13 ' A' ' 445' ' ' ILE . 0.3 OUTLIER -60.79 -40.88 94.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.048 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.405 ' HA ' HD12 ' A' ' 421' ' ' LEU . 3.3 tp -69.4 -31.83 70.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.824 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.54 -38.32 87.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.749 ' HG ' HG21 ' A' ' 386' ' ' VAL . 0.3 OUTLIER -58.82 -31.23 68.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.792 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.83 27.8 5.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.5 t -100.11 -29.75 12.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 4.3 m -93.77 123.79 46.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 154.58 22.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.985 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 88.4 m -111.19 -64.39 1.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 108.89 -121.9 6.37 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.442 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -106.01 36.14 4.59 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.395 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -106.9 100.19 9.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.835 0.35 . . . . 0.0 110.921 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.14 -33.93 76.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 4.1 t -60.99 -44.83 96.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.748 HG13 HD11 ' A' ' 383' ' ' ILE . 28.9 t -70.31 -42.45 78.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.152 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -59.62 -40.69 88.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.827 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.31 -41.78 98.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.05 89.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.978 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.81 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -66.67 -44.51 81.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.759 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -67.95 -39.73 83.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.682 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -71.19 -36.57 71.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.781 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.73 -45.54 82.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.001 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.916 ' HA ' HD12 ' A' ' 445' ' ' ILE . 38.6 t -64.58 -33.05 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.024 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 9.4 m -60.89 -43.98 97.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.17 -36.31 83.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.332 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.929 HD13 ' HB2' ' A' ' 420' ' ' LEU . 30.0 mt -63.93 -31.23 52.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -42.54 83.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.145 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.83 78.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.726 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.544 ' CG2' HG21 ' A' ' 397' ' ' VAL . 45.2 mt -65.07 -36.46 77.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.712 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -54.3 48.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.867 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -42.12 88.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.393 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -29.96 65.37 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.762 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -68.73 -38.24 80.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.289 179.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.77 -29.85 65.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.896 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.92 -23.57 25.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.221 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -20.06 37.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.775 0.321 . . . . 0.0 110.734 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -67.85 -86.73 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.026 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.489 HD23 ' HG2' ' A' ' 404' ' ' LYS . 1.1 pp . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.894 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.4 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 0.3 OUTLIER -72.76 -60.64 1.88 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.698 0.285 . . . . 0.0 110.932 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . 0.4 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 59.8 Cg_endo -72.48 -179.81 4.42 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.554 2.169 . . . . 0.0 112.33 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -143.6 157.02 44.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.934 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -94.87 -173.66 3.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.967 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 0.2 OUTLIER 69.16 136.5 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.925 -179.957 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.466 ' HD2' HG13 ' A' ' 380' ' ' ILE . 44.1 Cg_exo -57.07 -176.48 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.537 2.158 . . . . 0.0 112.344 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.402 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 73.9 Cg_endo -86.99 -30.32 0.33 Allowed 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.807 2.338 . . . . 0.0 113.27 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.1 t -90.5 -25.26 20.36 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 120.588 0.232 . . . . 0.0 111.56 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.626 HG22 HD11 ' A' ' 384' ' ' ILE . 42.5 mm -58.72 -29.66 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 16.9 mttt -56.74 -33.12 66.24 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.599 ' O ' HG23 ' A' ' 386' ' ' VAL . 24.3 mtmt -66.41 -38.04 86.56 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.204 0.526 . . . . 0.0 110.694 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 54.5 mt -60.5 -34.76 59.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.398 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.626 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.96 -44.58 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.224 178.392 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -56.65 -37.39 70.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.398 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 382' ' ' LYS . 68.5 t -73.52 -40.69 55.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.484 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.637 ' O ' HG12 ' A' ' 390' ' ' VAL . 1.2 tt -67.57 -37.54 82.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.327 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.94 -34.93 78.51 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -44.48 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.083 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.5 p -63.18 -41.19 91.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.426 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.4 ' HG3' ' N ' ' A' ' 392' ' ' TYR . 11.9 pt20 -63.28 -37.95 89.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.991 0.424 . . . . 0.0 110.433 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.4 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 1.8 m-85 -72.47 -39.83 67.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.427 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.797 HD11 ' HG2' ' A' ' 415' ' ' MET . 0.3 OUTLIER -62.11 -42.48 99.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.89 92.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.713 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -62.21 -35.37 78.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.662 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.28 -42.43 75.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.826 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.784 HG23 ' O ' ' A' ' 393' ' ' LEU . 14.5 t -60.66 -32.45 51.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.666 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -61.2 -36.16 79.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.96 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.503 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.9 tt0 -91.78 -68.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.993 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.858 ' CE1' HD13 ' A' ' 412' ' ' LEU . 6.6 t80 45.02 -84.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.714 -0.675 . . . . 0.0 112.611 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 399' ' ' GLU . 5.7 t 78.35 28.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.508 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -98.57 -150.76 26.35 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.501 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.624 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.44 171.09 14.54 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 120.439 0.162 . . . . 0.0 110.598 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.46 ' HD2' HG23 ' A' ' 405' ' ' THR . 0.0 OUTLIER -91.0 -10.17 43.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.58 0.228 . . . . 0.0 111.155 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . 0.46 HG23 ' HD2' ' A' ' 404' ' ' LYS . 30.8 p -115.73 -15.55 11.32 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.498 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 18.2 t70 -61.54 162.37 8.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.887 0.375 . . . . 0.0 111.341 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.736 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.36 -38.42 71.57 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.627 179.671 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.418 ' HA ' ' HB2' ' A' ' 411' ' ' LEU . . . -62.69 -29.02 70.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.655 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.624 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 60.4 t80 -57.5 -45.4 84.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.926 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.736 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.58 -29.44 63.53 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 118.865 -1.134 . . . . 0.0 108.663 178.15 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 0.4 OUTLIER -65.16 -39.34 92.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.356 177.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.858 HD13 ' CE1' ' A' ' 400' ' ' PHE . 8.3 tp -61.42 -47.04 87.58 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 30.6 tt0 -70.49 -32.27 69.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.688 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.563 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -64.02 -39.8 94.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.137 -179.426 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.797 ' HG2' HD11 ' A' ' 393' ' ' LEU . 41.2 ttm -69.74 -44.68 69.77 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.292 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 417' ' ' THR . 4.0 pp -68.75 -38.54 80.18 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.766 0.317 . . . . 0.0 110.683 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.78 ' N ' HD12 ' A' ' 416' ' ' LEU . 84.8 m -64.32 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.194 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.631 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -66.01 -42.36 89.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.294 179.509 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.59 -36.65 68.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.318 0.58 . . . . 0.0 110.038 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.839 ' HG ' HG13 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -67.77 -49.26 63.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.833 -179.361 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.982 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -69.74 -31.53 69.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.138 -0.225 . . . . 0.0 111.355 -178.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . 0.982 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -61.09 -46.55 90.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.842 0.353 . . . . 0.0 110.791 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.805 HD22 ' HA ' ' A' ' 438' ' ' ARG . 4.2 mt -69.8 -31.0 68.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.061 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -82.41 0.5 41.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.414 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.11 -42.64 8.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 110.945 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 21.4 t -66.97 136.21 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.216 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -112.6 -178.45 3.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -138.68 160.92 38.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.854 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -126.96 43.34 1.35 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.481 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 136.77 -28.45 2.85 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.495 ' HB3' HG23 ' A' ' 434' ' ' VAL . 72.8 mt-30 -76.95 96.36 4.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.881 0.372 . . . . 0.0 110.905 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.21 -30.06 69.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.982 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -42.93 89.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.962 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.495 HG23 ' HB3' ' A' ' 431' ' ' GLN . 31.2 t -62.78 -35.63 71.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -65.54 -43.81 88.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.12 -32.88 72.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.144 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -68.61 -45.17 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.417 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.806 ' O ' HG23 ' A' ' 442' ' ' VAL . 11.1 ptt85 -72.63 -44.53 61.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.127 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -63.01 -34.61 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.836 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.12 -39.71 65.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.79 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.787 ' HB3' HD13 ' A' ' 423' ' ' LEU . . . -71.01 -45.57 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.1 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.839 HG13 ' HG ' ' A' ' 420' ' ' LEU . 46.9 t -62.86 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.959 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 11.8 t -60.9 -35.55 76.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.68 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.55 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.823 HD12 ' CA ' ' A' ' 420' ' ' LEU . 1.1 mt -65.52 -31.24 52.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -43.95 97.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.127 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.41 86.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.608 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.745 ' CG2' HG21 ' A' ' 397' ' ' VAL . 43.9 mt -67.43 -36.39 76.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.842 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.3 tt -57.35 -47.48 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.888 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -41.35 98.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.804 0.335 . . . . 0.0 110.125 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -30.13 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.778 HD21 HD23 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -67.15 -38.42 85.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.378 179.044 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.37 -29.89 62.01 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -89.7 -20.08 24.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.402 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -20.29 36.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.006 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.43 -81.55 0.45 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.469 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.955 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.186 0 N-CA-C 112.541 -0.224 . . . . 0.0 112.541 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.407 ' N ' ' HD2' ' A' ' 373' ' ' PRO . 1.0 OUTLIER -63.74 -60.52 8.9 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.702 0.287 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 372' ' ' SER . 58.0 Cg_endo -71.4 -167.93 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.43 2.087 . . . . 0.0 112.325 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -143.37 -42.53 0.29 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.148 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 66.65 85.59 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.981 0.419 . . . . 0.0 110.78 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.623 HG21 ' HE3' ' A' ' 381' ' ' LYS . 0.2 OUTLIER 71.58 137.89 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.127 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.776 ' CG ' ' HB ' ' A' ' 380' ' ' ILE . 72.8 Cg_endo -71.94 -176.15 1.97 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.042 2.495 . . . . 0.0 112.571 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.474 ' CD ' ' HB2' ' A' ' 377' ' ' PRO . 41.0 Cg_endo -91.97 -74.75 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.003 2.469 . . . . 0.0 113.161 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 44.9 t -80.34 -24.16 40.07 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.776 ' HB ' ' CG ' ' A' ' 377' ' ' PRO . 1.6 mp -58.74 -28.82 38.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.623 ' HE3' HG21 ' A' ' 376' ' ' THR . 0.4 OUTLIER -55.78 -33.11 64.06 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.973 -179.055 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.646 ' O ' HG23 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -66.98 -37.99 85.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.211 0.529 . . . . 0.0 110.617 179.586 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.922 HG21 ' HB1' ' A' ' 437' ' ' ALA . 39.4 mm -60.54 -34.42 58.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.577 178.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.748 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.78 -44.39 45.84 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.608 178.62 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -56.42 -42.55 78.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.836 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.684 ' O ' HG23 ' A' ' 390' ' ' VAL . 38.4 t -70.85 -36.65 65.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.914 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.402 HD21 ' NZ ' ' A' ' 444' ' ' LYS . 0.2 OUTLIER -67.66 -36.05 80.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.157 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -35.1 78.69 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -34.61 73.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.81 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.703 HG22 ' HB3' ' A' ' 419' ' ' GLU . 25.7 t -74.85 -35.82 37.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.312 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.37 -41.01 83.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.581 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.28 -41.81 76.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.05 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.761 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -65.39 -37.94 88.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.328 179.384 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -60.9 -41.15 95.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -39.79 88.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.37 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -68.76 -39.17 80.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.524 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 393' ' ' LEU . 35.2 t -60.71 -34.46 58.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.605 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -59.02 -40.24 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.989 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 401' ' ' VAL . 1.8 tt0 -86.7 -68.23 0.76 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.823 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.868 ' CE1' HD13 ' A' ' 412' ' ' LEU . 4.7 t80 52.42 -80.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.454 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 401' ' ' VAL . 17.3 t 74.32 29.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.32 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . . . . . . . . . . . -101.86 -151.38 24.17 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.654 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.64 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.4 OUTLIER -133.46 171.13 14.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.559 0.219 . . . . 0.0 110.732 -179.853 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.487 ' HA ' ' CD1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -91.98 -8.89 44.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.072 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.81 -14.58 11.34 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.484 ' O ' ' HB3' ' A' ' 409' ' ' TYR . 33.8 t70 -63.62 163.05 11.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.913 0.387 . . . . 0.0 111.405 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.743 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.2 OUTLIER -71.52 -38.09 71.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.349 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.69 -28.94 70.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.622 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.64 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 58.4 t80 -58.26 -45.51 87.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.051 -179.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.743 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.0 OUTLIER -72.64 -30.75 64.57 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 118.92 -1.112 . . . . 0.0 108.658 178.165 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 8.6 tp -64.73 -39.54 93.81 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.135 177.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.868 HD13 ' CE1' ' A' ' 400' ' ' PHE . 7.0 tp -60.48 -46.96 88.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -70.35 -32.2 69.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.9 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.6 -43.25 97.46 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.955 -179.249 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -69.44 -34.9 75.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.279 0.561 . . . . 0.0 110.1 179.143 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.761 HD11 ' HB ' ' A' ' 445' ' ' ILE . 1.8 tm? -60.42 -40.81 92.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.04 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.738 HG22 HD13 ' A' ' 421' ' ' LEU . 1.8 m -71.71 -32.46 67.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.006 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -47.11 84.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.539 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.703 ' HB3' HG22 ' A' ' 390' ' ' VAL . 8.8 mm-40 -63.58 -43.03 98.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.121 0.486 . . . . 0.0 109.703 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.637 HD11 HG22 ' A' ' 442' ' ' VAL . 2.8 tp -62.06 -43.59 98.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.14 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.738 HD13 HG22 ' A' ' 417' ' ' THR . 4.9 mp -61.78 -31.85 72.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.95 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -71.06 -37.14 72.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.741 HD22 ' CB ' ' A' ' 441' ' ' ALA . 0.5 OUTLIER -67.79 -31.02 70.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.925 179.915 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.16 -8.17 55.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.54 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.8 t -53.44 -30.13 38.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.802 0.334 . . . . 0.0 111.169 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . 0.579 HG11 HD11 ' A' ' 383' ' ' ILE . 12.1 m -70.79 131.18 34.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -85.58 -30.27 23.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.959 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.706 HG23 ' HB ' ' A' ' 434' ' ' VAL . 16.6 m 61.69 157.62 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.831 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -143.73 60.6 0.52 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.575 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 70.39 28.99 70.47 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.462 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -106.43 117.7 34.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.869 0.366 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.33 -31.44 70.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.85 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.0 t -60.31 -44.8 95.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.842 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.706 ' HB ' HG23 ' A' ' 428' ' ' THR . 26.5 t -75.44 -40.88 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -61.66 -40.99 96.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -34.82 75.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.922 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -67.25 -45.03 77.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.202 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 442' ' ' VAL . 7.2 ptm180 -71.15 -41.12 70.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.933 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 13.4 ttpt -62.2 -31.53 72.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.762 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -72.24 -37.6 69.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.731 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.741 ' CB ' HD22 ' A' ' 423' ' ' LEU . . . -66.64 -45.58 78.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.096 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.637 HG22 HD11 ' A' ' 420' ' ' LEU . 20.1 t -71.73 -30.74 39.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 46.8 t -70.71 -46.72 62.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.977 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . 0.402 ' NZ ' HD21 ' A' ' 387' ' ' LEU . 0.3 OUTLIER -68.11 -44.72 75.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.028 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.761 ' HB ' HD11 ' A' ' 416' ' ' LEU . 2.7 pp -63.35 -31.12 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.462 . . . . 0.0 110.771 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.465 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -63.41 -45.76 89.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.271 179.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.89 -34.19 74.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.536 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 445' ' ' ILE . 17.1 mt -74.75 -36.48 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.723 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 449' ' ' LEU . 0.2 OUTLIER -57.51 -53.87 53.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.861 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -61.46 -44.08 97.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.823 0.344 . . . . 0.0 110.342 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -29.75 65.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.753 HD21 HD23 ' A' ' 412' ' ' LEU . 0.5 OUTLIER -71.88 -40.04 69.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.803 179.479 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 454' ' ' LYS . 0.0 OUTLIER -64.28 -29.84 70.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.786 0.327 . . . . 0.0 110.841 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . 0.438 ' N ' ' HG3' ' A' ' 453' ' ' GLU . 0.3 OUTLIER -91.6 -13.96 31.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.301 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -82.51 -25.7 33.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.976 0.417 . . . . 0.0 110.465 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -72.66 -64.05 2.7 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.263 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.163 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.421 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 1.0 OUTLIER -178.72 -61.4 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.68 0.276 . . . . 0.0 110.876 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 60.3 Cg_endo -72.59 -28.83 13.87 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.484 2.123 . . . . 0.0 112.297 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -102.28 31.19 4.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -109.94 75.03 0.92 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.87 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.407 HG22 ' CB ' ' A' ' 381' ' ' LYS . 0.1 OUTLIER -148.33 135.88 10.82 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.13 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.662 ' CG ' ' HB ' ' A' ' 380' ' ' ILE . 59.0 Cg_endo -70.17 175.25 8.69 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.783 2.322 . . . . 0.0 112.212 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 377' ' ' PRO . 10.9 Cg_endo -54.85 -77.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.602 2.201 . . . . 0.0 113.495 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 382' ' ' LYS . 0.2 OUTLIER -102.37 -23.02 14.0 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -178.628 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.781 ' HA ' HD12 ' A' ' 383' ' ' ILE . 1.1 mm -58.74 -29.55 40.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.474 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.57 -33.22 65.95 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.631 -179.344 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.522 ' HG3' ' N ' ' A' ' 383' ' ' ILE . 0.1 OUTLIER -68.35 -37.63 80.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.077 0.465 . . . . 0.0 110.732 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 380' ' ' ILE . 16.2 mt -60.97 -34.06 58.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.482 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.474 HG12 ' HA ' ' A' ' 381' ' ' LYS . 0.2 OUTLIER -74.97 -44.64 44.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.225 178.526 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -56.49 -47.57 78.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.334 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.582 ' O ' HG23 ' A' ' 390' ' ' VAL . 11.2 p -66.46 -37.38 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.189 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.57 -34.24 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.142 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 12.1 mt-10 -62.74 -34.83 78.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.57 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -70.27 -34.7 73.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.451 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' ' 386' ' ' VAL . 21.5 t -69.87 -46.35 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.353 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 394' ' ' GLU . 14.5 pt20 -58.46 -37.49 75.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.696 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.408 ' O ' ' CG ' ' A' ' 395' ' ' GLN . 19.1 t80 -72.34 -35.1 68.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.205 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.674 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -70.35 -37.84 74.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.728 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 391' ' ' GLN . 0.0 OUTLIER -64.87 -38.88 92.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . 0.42 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 12.0 pt20 -69.77 -31.65 69.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.849 0.357 . . . . 0.0 110.467 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -68.73 -39.37 80.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.653 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.731 HG13 ' CD2' ' A' ' 412' ' ' LEU . 42.6 t -60.74 -47.29 93.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.593 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -56.69 -38.69 72.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.462 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -74.28 -58.09 3.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.38 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.838 ' CE1' HD22 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -56.86 125.15 21.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.367 0.603 . . . . 0.0 110.456 179.729 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.571 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.7 p -116.53 43.9 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.512 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.576 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.8 -164.3 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.841 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.452 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.83 143.79 48.57 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.789 0.328 . . . . 0.0 111.632 -179.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.494 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 7.9 mttt -61.53 -21.13 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.941 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 405' ' ' THR . 23.7 m -94.22 8.67 40.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.85 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.452 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t70 -115.07 161.78 17.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.976 0.417 . . . . 0.0 111.027 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.736 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.59 -30.0 65.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.3 179.438 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.62 ' HB1' ' HE2' ' A' ' 400' ' ' PHE . . . -62.81 -29.41 70.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.1 -179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.494 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 6.1 t80 -73.72 -46.13 47.89 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.296 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.736 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.3 p-90 -73.08 -29.01 62.64 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 118.853 -1.139 . . . . 0.0 108.78 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.613 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.6 tp -67.35 -39.81 85.77 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.886 177.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.838 HD22 ' CE1' ' A' ' 400' ' ' PHE . 2.6 tp -59.67 -46.91 87.63 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 416' ' ' LEU . 1.6 tt0 -69.85 -31.68 69.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.421 177.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.613 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 2.4 mm-40 -63.48 -38.67 92.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.271 -179.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 1.9 mmt -69.72 -44.64 69.89 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.749 0.309 . . . . 0.0 111.004 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.875 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.0 -37.17 78.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.578 -179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.875 ' N ' HD12 ' A' ' 416' ' ' LEU . 1.0 OUTLIER -68.38 -43.75 76.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.733 0.302 . . . . 0.0 111.152 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -57.98 -47.22 83.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.382 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.451 ' OE2' HD13 ' A' ' 393' ' ' LEU . 13.6 pt-20 -65.9 -34.94 79.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.598 ' HB2' HG21 ' A' ' 445' ' ' ILE . 0.2 OUTLIER -67.05 -39.05 86.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.1 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.32 -31.8 69.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.918 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.01 -44.42 76.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.921 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.01 -35.86 77.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.878 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -79.35 -20.89 46.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 16.7 t -54.02 -30.91 49.53 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.89 0.376 . . . . 0.0 111.036 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.7 t -79.65 116.08 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.961 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.23 -34.01 61.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.447 HG22 ' HB2' ' A' ' 431' ' ' GLN . 0.2 OUTLIER 66.32 131.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.127 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.98 -89.2 1.79 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.372 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -107.86 64.63 0.26 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.335 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.497 ' HB3' HG23 ' A' ' 434' ' ' VAL . 49.4 mm-40 -139.56 87.5 2.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.851 0.358 . . . . 0.0 110.899 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -40.95 95.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.975 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 2.9 t -59.11 -43.28 91.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.011 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 431' ' ' GLN . 34.3 t -69.11 -35.53 68.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -44.47 78.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -69.31 -33.0 72.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.998 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.51 -44.73 67.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.433 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.897 ' O ' HG23 ' A' ' 442' ' ' VAL . 6.4 ptm180 -69.52 -40.66 76.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.214 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -44.9 82.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.891 0.377 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -69.82 -39.44 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.524 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.136 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 438' ' ' ARG . 41.0 t -62.94 -45.6 98.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.072 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . 0.599 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.6 m -60.38 -30.35 69.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.725 0.297 . . . . 0.0 110.213 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . 0.42 ' O ' HG13 ' A' ' 448' ' ' ILE . 37.9 tttp -63.94 -43.14 96.73 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.893 ' HA ' HD12 ' A' ' 448' ' ' ILE . 0.9 OUTLIER -73.62 -34.85 42.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.935 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.599 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.3 OUTLIER -60.7 -48.02 83.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.709 178.871 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -55.85 -42.7 76.21 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.72 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 445' ' ' ILE . 11.3 mt -64.52 -36.33 77.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.837 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.13 -44.66 83.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.894 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 -44.07 64.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 0.0 110.193 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 31.1 mtmm -57.86 -29.94 65.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.17 0.509 . . . . 0.0 109.666 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.759 HD11 HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -73.73 -36.71 65.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.441 179.304 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -29.98 67.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -93.68 -19.34 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm -82.55 -20.81 35.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.735 0.303 . . . . 0.0 110.919 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.42 ' HA3' ' CD2' ' A' ' 409' ' ' TYR . . . -82.12 -101.37 0.43 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.43 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.278 -0.868 . . . . 0.0 110.945 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.112 0 N-CA-C 112.524 -0.23 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 19.5 m -115.52 86.06 14.59 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.713 0.292 . . . . 0.0 110.872 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.14 -170.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.588 2.192 . . . . 0.0 112.319 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -64.2 -18.13 64.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.263 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 62.7 122.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.84 0.352 . . . . 0.0 111.013 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.02 129.13 9.59 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.863 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.482 ' HD2' HG13 ' A' ' 380' ' ' ILE . 59.5 Cg_exo -52.57 -179.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.584 2.189 . . . . 0.0 112.322 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -80.1 -37.06 0.46 Allowed 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 123.122 2.548 . . . . 0.0 113.105 -179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.03 -23.37 23.8 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.73 HG22 HD11 ' A' ' 384' ' ' ILE . 31.2 mm -58.65 -29.75 40.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.486 ' HA ' HG12 ' A' ' 384' ' ' ILE . 11.5 mttt -56.77 -33.17 66.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.047 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.603 ' O ' HG23 ' A' ' 386' ' ' VAL . 4.2 pttm -68.27 -38.0 81.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.164 0.507 . . . . 0.0 110.517 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.571 HG21 ' HB1' ' A' ' 437' ' ' ALA . 43.6 mm -60.5 -33.37 54.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.521 178.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.73 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.84 -44.73 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.209 178.495 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -57.0 -49.38 75.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.48 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 382' ' ' LYS . 40.9 t -64.15 -36.13 75.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.41 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.596 HD23 ' O ' ' A' ' 387' ' ' LEU . 6.0 tt -67.46 -34.54 77.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.375 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . 0.442 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.0 tt0 -62.77 -35.0 78.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.622 179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -70.41 -34.57 72.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.728 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.679 HG22 ' OE2' ' A' ' 419' ' ' GLU . 25.8 t -65.35 -46.91 89.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 4.6 pt20 -63.15 -37.76 88.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.84 0.352 . . . . 0.0 110.708 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.22 -36.87 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.09 179.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.924 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.5 mt -65.91 -37.77 86.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.296 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . 0.409 ' HG3' ' CD1' ' A' ' 448' ' ' ILE . 2.6 mt-10 -58.7 -44.53 90.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.561 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -41.35 89.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.461 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -69.2 -39.92 78.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.013 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 393' ' ' LEU . 25.2 t -60.62 -30.66 47.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.803 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -66.83 -33.13 74.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.415 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' A' ' 400' ' ' PHE . 16.5 tt0 -89.43 -55.41 3.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.533 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.962 ' CD2' HD22 ' A' ' 412' ' ' LEU . 13.8 t80 -20.35 120.27 0.03 OUTLIER 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 401' ' ' VAL . 11.6 p -100.5 29.43 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.625 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.563 ' HA3' ' CE2' ' A' ' 400' ' ' PHE . . . -41.9 162.8 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.527 -0.761 . . . . 0.0 113.777 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.543 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 1.4 mppt? -133.56 143.67 48.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.151 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -17.46 53.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.703 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 4.4 m -108.4 -15.54 14.43 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.547 ' OD1' ' HB3' ' A' ' 408' ' ' ALA . 14.2 t70 -76.24 135.25 39.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.925 0.393 . . . . 0.0 110.743 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.741 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 1.6 mptp? -61.13 -30.82 70.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.214 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.547 ' HB3' ' OD1' ' A' ' 406' ' ' ASP . . . -65.41 -29.13 69.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.409 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 0.2 OUTLIER -68.95 -45.59 70.34 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.539 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.741 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 15.7 p-90 -72.86 -30.13 63.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.069 -1.053 . . . . 0.0 108.886 178.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 25.9 tp -69.76 -38.56 76.81 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.327 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.973 HD23 HD11 ' A' ' 452' ' ' LEU . 0.4 OUTLIER -62.09 -47.26 85.42 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.147 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.823 ' HA ' HD12 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.58 -32.28 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.302 177.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.77 -36.42 83.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.532 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.617 ' CE ' HD21 ' A' ' 393' ' ' LEU . 10.9 ttt -69.57 -41.05 76.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.004 0.431 . . . . 0.0 110.171 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.823 HD12 ' HA ' ' A' ' 413' ' ' GLU . 3.9 mt -62.43 -46.92 86.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.639 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.531 HG22 HD13 ' A' ' 421' ' ' LEU . 7.6 m -65.8 -30.44 71.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.767 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -47.31 86.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.159 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.679 ' OE2' HG22 ' A' ' 390' ' ' VAL . 8.5 pt-20 -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.584 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.78 HD21 HG22 ' A' ' 442' ' ' VAL . 3.4 tm? -68.49 -38.85 81.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.472 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.531 HD13 HG22 ' A' ' 417' ' ' THR . 1.3 mp -66.56 -31.98 73.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.668 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -45.07 86.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.748 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.533 HD11 HG11 ' A' ' 386' ' ' VAL . 5.5 mt -57.69 -32.57 67.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -79.88 -31.84 40.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 10.0 t -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . 0.44 HG11 ' HE3' ' A' ' 382' ' ' LYS . 21.5 t -80.56 119.64 30.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.078 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -70.39 131.66 44.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.933 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.402 ' CG2' HG11 ' A' ' 434' ' ' VAL . 19.0 p -108.48 -36.91 6.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.888 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 90.39 -91.96 1.73 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.488 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -152.54 47.78 0.55 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.5 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.443 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.1 OUTLIER -93.01 115.64 28.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 0.0 110.797 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -42.97 80.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 25.6 t -64.2 -44.86 90.66 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.923 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.443 HG23 ' HB3' ' A' ' 431' ' ' GLN . 37.8 t -69.55 -40.76 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -44.35 91.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.926 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -38.35 78.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.571 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -66.64 -45.13 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.273 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.707 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.2 ptm180 -68.11 -39.37 82.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.956 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -66.25 -34.44 78.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -71.39 -39.34 71.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.88 97.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.158 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.78 HG22 HD21 ' A' ' 420' ' ' LEU . 31.5 t -62.85 -39.64 85.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.996 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -36.63 79.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.492 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -34.69 78.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.572 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 442' ' ' VAL . 3.1 mm -66.78 -31.19 52.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.14 0.495 . . . . 0.0 110.751 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -45.99 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.663 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.47 -38.46 87.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.039 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.771 ' CG2' HG21 ' A' ' 397' ' ' VAL . 16.3 mt -74.83 -36.57 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.51 -43.56 84.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.938 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.77 62.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.629 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -57.84 -32.67 67.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 109.808 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.973 HD11 HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -77.64 -36.6 51.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.402 179.145 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.17 -30.0 61.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.553 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -91.95 -12.4 33.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.176 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -82.16 -26.4 33.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.125 0.488 . . . . 0.0 110.828 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -82.97 -96.32 0.55 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.375 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.008 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 112.555 -0.218 . . . . 0.0 112.555 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 1.7 m -155.3 58.01 1.79 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.333 . . . . 0.0 110.889 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.54 -169.83 0.34 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.56 2.173 . . . . 0.0 112.285 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 60.5 100.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.948 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -164.78 147.8 8.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.946 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 5.1 p -63.97 109.61 2.88 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.845 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.474 ' HD2' HG13 ' A' ' 380' ' ' ILE . 17.8 Cg_exo -67.29 153.52 76.85 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.671 2.247 . . . . 0.0 111.964 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.46 -14.66 30.9 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.458 2.105 . . . . 0.0 113.146 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 81.3 p -96.68 -26.1 15.31 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.694 0.283 . . . . 0.0 111.461 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.629 HG22 HD11 ' A' ' 384' ' ' ILE . 28.9 mm -58.6 -29.65 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.473 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -33.2 66.35 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.849 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -67.25 -38.02 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.091 0.472 . . . . 0.0 110.836 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 380' ' ' ILE . 34.3 mt -60.52 -34.54 58.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.376 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.629 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.94 -44.67 44.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.318 178.444 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -57.02 -49.35 76.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.411 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.52 -37.78 80.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.483 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.627 ' O ' HG12 ' A' ' 390' ' ' VAL . 4.3 tt -67.57 -32.96 74.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.82 -35.21 79.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.48 66.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.147 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 387' ' ' LEU . 2.4 p -63.5 -39.09 84.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.479 -179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.16 -34.52 77.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.901 0.381 . . . . 0.0 110.627 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.99 -43.46 95.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.579 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.65 HD13 ' OE1' ' A' ' 419' ' ' GLU . 0.2 OUTLIER -60.55 -37.91 82.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.596 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -58.79 -44.05 90.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.485 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.62 -31.65 72.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.509 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -68.42 -44.17 75.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.837 HG22 HD11 ' A' ' 412' ' ' LEU . 19.7 t -60.68 -38.05 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.821 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -59.49 -32.58 70.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.522 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 401' ' ' VAL . 9.6 tt0 -78.63 -57.35 3.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.555 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.662 ' CG ' HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -60.34 127.7 33.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.288 0.566 . . . . 0.0 110.53 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.575 ' O ' HG12 ' A' ' 401' ' ' VAL . 22.1 t -123.11 39.86 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.401 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.545 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -53.76 -166.13 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.678 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.518 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.96 149.19 51.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.936 0.398 . . . . 0.0 111.853 -179.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.493 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 2.0 mmmt -58.78 -25.09 62.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.081 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 70.9 p -85.94 3.7 40.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.448 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.518 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 26.4 t70 -111.96 156.68 21.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.111 0.482 . . . . 0.0 111.432 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.759 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 5.4 mttp -69.31 -29.97 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.039 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.516 ' HB1' ' HE2' ' A' ' 400' ' ' PHE . . . -62.87 -29.42 70.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.328 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.493 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 33.1 t80 -69.2 -45.53 69.65 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.969 -179.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.759 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.3 OUTLIER -72.63 -32.66 66.07 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 118.628 -1.229 . . . . 0.0 108.539 178.162 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.588 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 17.8 tp -63.57 -38.35 90.79 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.837 HD11 HG22 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -59.71 -47.15 86.8 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.465 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.493 ' HG2' HD13 ' A' ' 452' ' ' LEU . 4.8 mm-40 -70.38 -31.78 69.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.893 177.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.588 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.32 -40.17 96.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.222 -178.581 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.62 -44.2 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.222 0.534 . . . . 0.0 109.909 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.836 HD11 HG23 ' A' ' 445' ' ' ILE . 7.0 tp -66.36 -41.0 90.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.78 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.43 ' HA ' ' CD2' ' A' ' 420' ' ' LEU . 94.9 m -62.69 -30.36 71.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -71.01 -44.65 65.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.596 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.799 ' O ' HD12 ' A' ' 423' ' ' LEU . 15.8 pt-20 -64.23 -44.64 91.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.625 0.25 . . . . 0.0 111.41 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.961 ' HB2' HD13 ' A' ' 445' ' ' ILE . 1.4 pp -66.27 -35.34 80.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.893 0.378 . . . . 0.0 110.511 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.59 HD12 ' CD1' ' A' ' 420' ' ' LEU . 3.9 mp -70.31 -31.87 69.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.446 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.53 -46.28 90.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 419' ' ' GLU . 1.8 mp -66.12 -31.01 71.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.719 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -58.37 -26.5 63.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.01 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.05 38.35 1.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.863 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 14.2 p -91.19 130.02 41.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.64 -70.13 0.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.984 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.509 ' OG1' HG11 ' A' ' 434' ' ' VAL . 27.5 m 67.25 -69.5 0.13 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.028 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 98.37 -60.58 0.92 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 177.76 38.39 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.421 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.528 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.9 OUTLIER -93.43 120.08 33.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.818 0.342 . . . . 0.0 110.926 -179.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -31.07 69.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 21.5 t -65.42 -42.03 92.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.932 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.528 HG23 ' HB3' ' A' ' 431' ' ' GLN . 39.9 t -68.29 -37.45 77.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.92 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.755 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.16 -34.37 74.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.924 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.04 -45.16 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.504 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.0 OUTLIER -66.45 -44.24 83.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.972 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -60.46 -39.45 87.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -69.76 -31.71 69.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.727 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.421 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -69.4 -45.66 68.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.11 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 1.005 ' HA ' HD12 ' A' ' 445' ' ' ILE . 25.6 t -64.25 -34.3 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.866 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -45.09 95.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.215 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -37.2 86.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.083 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 1.005 HD12 ' HA ' ' A' ' 442' ' ' VAL . 24.2 mt -64.36 -32.73 58.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.704 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.58 -47.59 83.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.011 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.84 -42.45 93.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.17 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.413 ' CG2' HD22 ' A' ' 416' ' ' LEU . 34.2 mt -63.6 -36.56 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.803 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.417 HD12 ' OE2' ' A' ' 413' ' ' GLU . 2.3 tp -57.58 -47.59 81.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.817 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -34.53 68.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -57.87 -33.2 68.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.987 0.422 . . . . 0.0 110.313 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.83 HD21 HD12 ' A' ' 412' ' ' LEU . 1.8 mt -77.66 -36.79 51.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.434 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.92 -29.87 63.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.791 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -22.2 17.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.059 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -82.43 -19.88 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.958 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -86.32 -103.51 0.76 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.418 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.963 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.419 -0.272 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 7.5 t -151.38 131.39 6.97 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.541 0.21 . . . . 0.0 110.845 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.75 107.86 0.24 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.37 2.047 . . . . 0.0 112.305 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.05 119.33 6.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.87 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.77 -60.6 0.37 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.83 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.43 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 1.4 m -115.11 134.77 22.48 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.805 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.729 ' HD2' HD12 ' A' ' 380' ' ' ILE . 37.3 Cg_exo -60.93 177.79 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.474 2.116 . . . . 0.0 112.131 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -89.88 2.09 5.41 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.815 2.343 . . . . 0.0 113.199 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.03 -23.67 6.28 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.729 HD12 ' HD2' ' A' ' 377' ' ' PRO . 6.0 mt -58.85 -29.91 41.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.468 ' HA ' HG12 ' A' ' 384' ' ' ILE . 1.3 mttt -56.96 -33.15 66.76 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.868 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.593 ' O ' HG23 ' A' ' 386' ' ' VAL . 2.8 mttm -66.69 -38.04 85.98 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 33.7 mm -60.52 -35.59 64.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.293 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.586 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.2 OUTLIER -74.91 -44.55 44.9 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.387 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.516 178.383 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -49.25 75.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.782 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.774 HG11 ' HB3' ' A' ' 423' ' ' LEU . 46.5 t -63.77 -33.65 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.672 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.25 -37.84 84.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.558 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 10.3 mt-10 -62.6 -34.64 77.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.744 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -67.58 -34.66 77.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.477 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.714 HG22 HD11 ' A' ' 445' ' ' ILE . 32.4 t -66.21 -46.69 86.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.2 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 11.7 pt20 -62.89 -40.47 97.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.863 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.415 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 0.2 OUTLIER -68.92 -44.18 73.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.855 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.729 ' O ' HG23 ' A' ' 397' ' ' VAL . 1.1 mm? -58.57 -40.26 82.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.764 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -59.8 -46.61 88.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.018 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.5 -36.14 75.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.14 -41.73 76.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.388 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 393' ' ' LEU . 19.7 t -60.57 -45.75 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.328 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -24.12 31.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.006 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.835 ' O ' HG23 ' A' ' 401' ' ' VAL . 22.6 tt0 -95.77 -55.72 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 1.003 ' CE1' HD22 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -51.85 -27.08 11.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 -179.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.835 HG23 ' O ' ' A' ' 399' ' ' GLU . 21.1 t 66.4 -44.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.627 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.559 ' CA ' ' CZ ' ' A' ' 400' ' ' PHE . . . 68.22 158.22 1.18 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.013 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.534 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.3 OUTLIER -133.3 143.6 49.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.601 179.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -67.68 -15.05 63.45 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.6 t -115.54 8.96 15.28 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 35.9 t0 -100.67 136.6 40.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.833 0.349 . . . . 0.0 110.8 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.763 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.31 -31.8 71.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.887 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.97 -29.03 70.5 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.712 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.534 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -65.9 -45.31 82.42 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.763 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 3.9 p-90 -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.177 178.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.581 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 18.0 tp -69.65 -38.89 77.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.642 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 1.003 HD22 ' CE1' ' A' ' 400' ' ' PHE . 0.3 OUTLIER -62.55 -46.99 85.86 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.141 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.852 ' HG2' HD13 ' A' ' 452' ' ' LEU . 21.5 mt-10 -70.32 -32.42 70.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.429 177.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.581 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 4.5 mt-10 -66.38 -44.6 82.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.9 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 412' ' ' LEU . 8.3 ptm -65.71 -42.43 91.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.679 0.276 . . . . 0.0 111.312 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.658 HD21 ' HA ' ' A' ' 413' ' ' GLU . 3.1 pp -67.24 -36.69 82.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.907 0.384 . . . . 0.0 110.663 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.572 ' N ' HD12 ' A' ' 416' ' ' LEU . 0.7 OUTLIER -62.79 -33.89 76.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.737 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.637 ' HA ' HD12 ' A' ' 421' ' ' LEU . 7.8 mttt -73.06 -34.15 66.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.052 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 416' ' ' LEU . 7.7 pt-20 -72.83 -38.31 67.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.849 HD12 ' N ' ' A' ' 421' ' ' LEU . 4.3 pp -70.5 -43.71 69.13 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.986 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.56 -31.45 68.48 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.163 -179.288 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . 0.986 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.1 OUTLIER -64.35 -46.72 82.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.82 0.343 . . . . 0.0 111.47 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.774 ' HB3' HG11 ' A' ' 386' ' ' VAL . 1.9 pp -68.02 -30.94 70.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.167 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 -3.83 41.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.525 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 3.2 m -86.16 -5.03 59.28 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.553 0.216 . . . . 0.0 111.56 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 423' ' ' LEU . 26.8 m -66.68 137.82 24.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.864 0.364 . . . . 0.0 111.066 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -73.06 156.49 38.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.887 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 69.1 p -137.24 110.68 7.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.907 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -82.43 -37.0 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.439 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 172.81 49.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.486 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.405 ' HB3' HG23 ' A' ' 434' ' ' VAL . 15.9 mt-30 -126.73 111.33 14.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.772 0.32 . . . . 0.0 110.93 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -67.1 -32.45 73.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.929 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -40.94 96.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 431' ' ' GLN . 25.8 t -71.57 -39.82 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.093 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -44.67 90.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.745 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.53 -43.17 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.161 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.18 91.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.754 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.429 ' O ' HG23 ' A' ' 442' ' ' VAL . 10.1 ptt85 -70.31 -40.42 74.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.68 0.276 . . . . 0.0 111.042 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.84 -32.91 74.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.07 -41.98 63.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.401 ' O ' HG13 ' A' ' 445' ' ' ILE . . . -62.03 -45.57 92.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.21 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.771 HG13 ' HB2' ' A' ' 420' ' ' LEU . 46.2 t -69.55 -38.83 77.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.712 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.36 -39.21 93.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.873 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -63.19 -40.72 98.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.515 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.714 HD11 HG22 ' A' ' 390' ' ' VAL . 0.5 OUTLIER -63.81 -31.18 52.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.798 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -64.2 -41.04 97.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.879 179.327 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.62 -37.27 83.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.237 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . . . . . . . . . 31.7 mt -67.3 -36.4 76.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.58 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 446' ' ' GLN . 1.8 mt -57.29 -46.99 82.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.5 -46.13 89.83 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -58.43 -30.02 66.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.241 0.543 . . . . 0.0 109.614 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.876 HD11 HD23 ' A' ' 412' ' ' LEU . 1.0 OUTLIER -77.29 -36.77 53.89 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.335 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -61.73 -31.8 71.99 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.38 -19.35 20.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.971 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.9 mtmt -82.45 -23.37 34.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.353 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.422 ' HA2' ' O ' ' A' ' 402' ' ' GLY . . . -72.32 -93.13 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 1.6 mp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.217 179.796 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.419 ' CB ' ' CD ' ' A' ' 373' ' ' PRO . 0.0 OUTLIER -178.6 -61.82 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.652 0.263 . . . . 0.0 110.892 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . 0.419 ' CD ' ' CB ' ' A' ' 372' ' ' SER . 58.6 Cg_endo -71.51 -27.48 18.84 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.456 2.104 . . . . 0.0 112.376 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -128.45 -177.03 4.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.876 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -95.7 -69.51 0.75 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.059 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 3.2 m 57.63 105.03 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.868 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.532 ' HG2' HG13 ' A' ' 380' ' ' ILE . 72.5 Cg_exo -52.26 -176.2 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.499 2.133 . . . . 0.0 112.638 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 10.1 Cg_exo -72.19 -68.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.036 2.491 . . . . 0.0 113.625 -178.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 63.7 m -70.34 -20.67 62.97 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 -178.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.639 HG22 HD11 ' A' ' 384' ' ' ILE . 34.1 mm -58.68 -30.11 41.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.418 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -59.0 -33.32 70.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.884 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.453 ' O ' HG23 ' A' ' 386' ' ' VAL . 7.5 mtpp -68.19 -38.12 81.66 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.17 0.509 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . . . . . . . . . 37.9 mm -60.45 -34.55 58.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.411 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.639 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.95 -44.72 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.414 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -47.19 80.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.009 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.495 HG12 HD21 ' A' ' 423' ' ' LEU . 47.5 t -70.39 -42.85 78.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.124 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.08 -38.88 92.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.771 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -62.75 -34.71 77.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -40.9 96.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.389 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.57 HG13 ' CD1' ' A' ' 445' ' ' ILE . 56.2 t -61.42 -37.94 78.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.591 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -41.13 93.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.71 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -72.53 -44.54 62.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.642 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.667 ' O ' HG23 ' A' ' 397' ' ' VAL . 3.5 mm? -59.01 -42.48 90.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.755 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.28 -44.33 95.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -35.86 77.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.015 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -45.02 71.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.792 HG21 ' CG2' ' A' ' 448' ' ' ILE . 17.1 t -60.58 -39.6 81.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.975 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -58.52 -38.91 78.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.012 0.434 . . . . 0.0 110.333 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 21.2 tt0 -80.67 -54.45 5.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.349 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.616 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 42.8 t80 -21.4 116.86 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.401 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 25.5 m -111.21 27.03 2.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.192 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.616 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -54.72 -172.82 0.08 OUTLIER Glycine 0 N--CA 1.442 -0.962 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.326 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.515 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.89 143.86 48.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.781 -0.71 . . . . 0.0 111.236 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.406 ' HB2' ' CA ' ' A' ' 457' ' ' LEU . 0.0 OUTLIER -52.25 -27.38 14.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.525 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.32 11.32 29.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.599 -179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -93.17 142.67 27.04 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.784 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.19 -30.29 70.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.983 0.42 . . . . 0.0 110.665 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -68.0 -29.16 68.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.836 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.515 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 1.1 t80 -66.52 -45.29 79.99 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.784 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 9.3 p-90 -72.67 -30.58 64.39 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 119.045 -1.062 . . . . 0.0 109.13 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.591 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 24.8 tp -69.79 -38.49 76.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.303 177.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.594 HD23 ' CE1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -63.03 -47.07 84.63 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.092 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.504 ' HA ' HD21 ' A' ' 416' ' ' LEU . 0.2 OUTLIER -70.33 -32.04 69.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.372 177.86 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.1 OUTLIER -63.87 -41.46 97.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.49 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 18.5 ptp -69.58 -44.54 70.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.637 0.256 . . . . 0.0 111.448 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.737 HD12 ' N ' ' A' ' 417' ' ' THR . 4.3 pp -66.48 -37.1 84.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.884 0.373 . . . . 0.0 110.231 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.737 ' N ' HD12 ' A' ' 416' ' ' LEU . 99.2 m -62.85 -30.39 71.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.208 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.58 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.0 OUTLIER -72.24 -32.65 66.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.913 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.589 ' O ' HD12 ' A' ' 423' ' ' LEU . 6.8 mm-40 -72.72 -46.38 53.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.307 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 421' ' ' LEU . 2.5 pp -62.96 -46.21 88.79 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.21 -178.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.985 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -68.2 -31.44 70.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 110.817 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . 0.985 ' N ' HD13 ' A' ' 421' ' ' LEU . 1.3 tm-20 -58.33 -46.44 86.19 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.842 0.353 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.672 HD22 ' HB3' ' A' ' 441' ' ' ALA . 0.7 OUTLIER -69.08 -33.56 73.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.75 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -68.06 -28.3 67.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.962 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.5 p -96.57 38.53 1.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . 0.625 HG11 ' HG3' ' A' ' 438' ' ' ARG . 10.2 p -86.14 137.78 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.85 110.03 16.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.04 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.3 t -156.02 121.7 4.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -95.16 -49.25 2.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.476 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -136.32 62.96 0.59 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.498 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.596 ' HB3' HG23 ' A' ' 434' ' ' VAL . 41.1 mt-30 -139.27 84.94 2.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.823 0.344 . . . . 0.0 110.922 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.56 -31.89 69.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -42.32 99.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.596 HG23 ' HB3' ' A' ' 431' ' ' GLN . 30.8 t -66.33 -45.6 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.068 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.78 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -68.14 -47.21 68.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.884 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.1 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.008 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.833 ' O ' HG23 ' A' ' 442' ' ' VAL . 17.7 mmt180 -67.61 -36.64 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -66.94 -44.77 79.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.722 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.91 -34.7 76.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.672 ' HB3' HD22 ' A' ' 423' ' ' LEU . . . -70.32 -45.02 67.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.041 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.833 HG23 ' O ' ' A' ' 438' ' ' ARG . 24.9 t -62.92 -45.91 97.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.99 -34.11 74.29 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.526 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.06 -36.4 83.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.944 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.78 ' HA ' HD12 ' A' ' 448' ' ' ILE . 1.7 mm -68.42 -31.31 50.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.292 179.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.63 -47.69 83.52 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.762 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.68 -35.36 80.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.425 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.792 ' CG2' HG21 ' A' ' 397' ' ' VAL . 10.3 mt -74.58 -36.44 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.772 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.4 -55.4 35.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.687 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.07 -37.92 81.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.24 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 7.0 mtmm -57.86 -31.6 66.84 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.654 HD23 HG13 ' A' ' 397' ' ' VAL . 1.5 tm? -68.38 -38.95 81.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.393 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -60.81 -30.0 69.8 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.23 -15.74 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.131 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -22.65 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 110.837 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.68 -100.61 0.71 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.406 ' CA ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.993 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.4 m -93.94 147.75 34.04 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 120.677 0.275 . . . . 0.0 110.894 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.35 90.64 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.549 2.166 . . . . 0.0 112.294 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -137.92 -43.54 0.52 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.001 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 63.61 137.94 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.434 ' O ' ' CD ' ' A' ' 381' ' ' LYS . 13.3 p -152.02 73.55 7.79 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.362 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.602 ' CB ' ' HD3' ' A' ' 378' ' ' PRO . 5.3 Cg_exo -76.85 -63.91 0.03 OUTLIER 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 122.423 2.082 . . . . 0.0 114.611 -178.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.602 ' HD3' ' CB ' ' A' ' 377' ' ' PRO . 50.4 Cg_endo -102.76 -109.58 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 122.351 2.034 . . . . 0.0 114.414 -177.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.87 -19.95 7.71 Favored 'General case' 0 CA--C 1.519 -0.231 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.737 ' HA ' HD12 ' A' ' 383' ' ' ILE . 32.8 mm -58.71 -29.84 40.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.462 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.0 OUTLIER -56.75 -37.28 70.82 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.16 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -64.59 -38.19 90.16 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.028 0.442 . . . . 0.0 111.185 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 380' ' ' ILE . 16.6 mt -61.19 -35.24 64.49 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.328 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.629 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -75.05 -44.78 43.83 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.332 178.463 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -56.69 -49.41 75.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.918 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.752 HG21 HD11 ' A' ' 423' ' ' LEU . 8.4 p -65.69 -42.93 93.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.859 179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.649 HD23 HE21 ' A' ' 391' ' ' GLN . 0.4 OUTLIER -67.57 -32.65 73.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.784 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -35.18 79.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . 0.4 ' CD ' ' HB3' ' A' ' 419' ' ' GLU . 0.3 OUTLIER -70.38 -44.43 68.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.62 179.446 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 387' ' ' LEU . 1.6 p -66.45 -35.91 76.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.634 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.649 HE21 HD23 ' A' ' 387' ' ' LEU . 1.0 OUTLIER -60.16 -40.66 90.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.533 179.628 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -35.07 68.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.83 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -68.87 -43.57 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.121 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 395' ' ' GLN . 0.1 OUTLIER -68.07 -33.28 74.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.777 0.323 . . . . 0.0 110.788 179.933 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . 0.425 ' N ' ' HG3' ' A' ' 394' ' ' GLU . 1.8 tt0 -66.44 -35.59 80.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -69.1 -37.56 78.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.812 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.861 HG21 ' CG2' ' A' ' 448' ' ' ILE . 16.2 t -60.61 -40.49 84.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -55.86 -32.98 64.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.053 0.454 . . . . 0.0 110.301 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.43 ' O ' ' C ' ' A' ' 400' ' ' PHE . 30.6 tt0 -88.91 -54.34 4.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.296 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.672 ' CD1' HD23 ' A' ' 412' ' ' LEU . 35.1 t80 -20.84 124.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.131 -0.94 . . . . 0.0 113.299 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.0 p -120.9 24.77 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.392 178.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.636 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -59.61 -171.11 0.45 Allowed Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.949 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -133.83 143.45 48.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.288 -0.456 . . . . 0.0 111.354 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.463 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -53.1 -26.96 18.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.225 179.41 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.88 14.6 30.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.19 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -106.64 147.81 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.886 0.374 . . . . 0.0 110.957 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.794 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 2.3 ttpt -61.17 -30.33 70.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.691 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -66.09 -29.24 69.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.144 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 52.5 t80 -70.88 -45.94 63.49 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.794 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.5 OUTLIER -72.97 -30.56 63.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 118.612 -1.235 . . . . 0.0 108.568 177.716 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 39.1 tp -66.41 -40.03 89.34 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.016 177.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.672 HD23 ' CD1' ' A' ' 400' ' ' PHE . 0.2 OUTLIER -59.79 -47.04 87.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.613 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.527 ' HA ' HD21 ' A' ' 416' ' ' LEU . 29.8 mt-10 -70.32 -31.99 69.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.779 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.602 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -63.52 -41.41 98.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.712 -178.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.652 ' HB2' HD11 ' A' ' 393' ' ' LEU . 6.5 mmm -69.53 -44.67 70.49 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.906 0.384 . . . . 0.0 110.936 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.699 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -68.59 -36.83 79.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.158 179.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.71 ' HA ' HD23 ' A' ' 420' ' ' LEU . 95.4 m -72.03 -30.32 65.07 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.595 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -62.58 -47.45 83.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.572 -179.651 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 416' ' ' LEU . 1.2 pp20? -65.3 -46.44 80.35 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.71 HD23 ' HA ' ' A' ' 417' ' ' THR . 0.3 OUTLIER -60.55 -34.51 74.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.102 0.477 . . . . 0.0 109.877 179.303 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.35 -31.77 69.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.179 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.23 -46.41 85.95 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.376 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.914 ' O ' HG13 ' A' ' 426' ' ' VAL . 1.3 mt -70.29 -45.74 65.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.614 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 40.88 37.36 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.745 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 29.0 t 59.75 55.09 4.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . 0.914 HG13 ' O ' ' A' ' 423' ' ' LEU . 3.6 m -66.38 117.65 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.056 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.32 149.91 27.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.052 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . 0.519 HG23 ' NH1' ' A' ' 438' ' ' ARG . 72.4 p -110.86 -27.14 8.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.994 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 106.81 -27.19 17.14 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.354 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 168.42 41.27 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.27 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.44 ' HB3' HG23 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -116.46 96.86 5.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 0.0 110.958 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.86 -31.79 72.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.815 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.28 -43.85 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.835 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.555 HG12 ' CD ' ' A' ' 438' ' ' ARG . 38.8 t -68.08 -37.99 79.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -40.76 87.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -66.14 -38.3 87.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.787 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.68 -38.73 73.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.027 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.875 ' O ' HG23 ' A' ' 442' ' ' VAL . 6.0 mtp180 -62.13 -44.43 96.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.81 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -66.48 -37.05 84.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.81 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.47 -39.6 88.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.917 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.47 69.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.078 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 438' ' ' ARG . 31.8 t -62.88 -44.98 99.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.84 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.5 m -60.85 -34.91 75.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.236 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -63.16 -34.62 78.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.507 HG21 ' CD2' ' A' ' 420' ' ' LEU . 3.4 mm -66.35 -36.63 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-O 121.249 0.547 . . . . 0.0 110.531 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.92 -47.72 84.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.187 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.79 87.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.082 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.861 ' CG2' HG21 ' A' ' 397' ' ' VAL . 15.7 mt -73.52 -36.54 48.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.39 -46.67 83.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.905 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -38.33 70.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.524 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.85 -30.07 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.118 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.636 HD12 ' O ' ' A' ' 448' ' ' ILE . 2.1 mt -77.58 -36.62 51.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.594 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -29.96 60.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.857 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -96.6 -12.35 24.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.332 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.53 -24.02 34.29 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.746 0.308 . . . . 0.0 110.846 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.457 ' HA2' ' HA ' ' A' ' 403' ' ' LYS . . . -92.42 -76.19 1.32 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.632 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 60.67 88.27 0.12 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.723 0.297 . . . . 0.0 110.945 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -51.67 157.13 5.66 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.534 2.156 . . . . 0.0 112.27 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -107.05 179.67 4.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.948 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -158.05 31.72 0.25 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.9 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 2.8 m 63.17 143.1 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.888 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.47 ' HA ' ' HD3' ' A' ' 378' ' ' PRO . 17.4 Cg_exo -67.69 149.01 78.81 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.576 2.184 . . . . 0.0 111.982 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 377' ' ' PRO . 14.2 Cg_exo -69.03 -8.9 24.88 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.609 2.206 . . . . 0.0 113.004 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 93.6 p -103.26 -25.45 13.33 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.724 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.683 HG22 HD11 ' A' ' 384' ' ' ILE . 27.7 mm -58.76 -29.82 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.456 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.36 -33.25 67.59 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.983 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 386' ' ' VAL . 7.0 mttm -68.23 -38.1 81.5 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.174 0.512 . . . . 0.0 110.782 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.558 HD12 HD13 ' A' ' 380' ' ' ILE . 50.2 mt -60.5 -34.14 57.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.433 178.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.683 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.94 -44.8 44.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.469 178.649 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -58.57 -49.4 77.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.084 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.761 HG11 ' HB3' ' A' ' 423' ' ' LEU . 46.8 t -68.31 -46.17 81.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.156 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.846 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.77 -34.88 78.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.21 0.529 . . . . 0.0 109.834 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -38.96 81.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.506 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 386' ' ' VAL . 24.3 t -67.3 -36.0 75.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.741 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -41.11 96.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.664 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -69.82 -45.6 67.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.544 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.709 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -60.84 -38.0 83.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.59 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -60.68 -42.03 96.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.698 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -58.06 -44.82 87.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.827 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.25 -45.25 70.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.775 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 393' ' ' LEU . 58.2 t -60.64 -32.55 51.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.706 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.12 -34.72 76.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.044 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' O ' ' A' ' 400' ' ' PHE . 6.6 tt0 -91.43 -68.62 0.78 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.17 179.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.786 ' CE1' HD13 ' A' ' 412' ' ' LEU . 4.7 t80 54.55 157.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.591 0.71 . . . . 0.0 111.888 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 5.0 m -141.12 20.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.853 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.567 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -104.08 -170.46 25.12 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.889 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -134.14 143.93 48.24 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.58 -0.31 . . . . 0.0 111.68 -179.545 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 3.2 tttt -51.13 -28.77 11.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.138 179.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.74 14.34 32.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.391 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.19 164.97 11.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.816 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -71.41 -30.8 66.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.14 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.02 -29.14 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.027 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 18.5 t80 -69.38 -45.43 69.34 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.816 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 0.8 OUTLIER -72.79 -30.75 64.34 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.903 178.18 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -68.1 -39.33 82.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.454 177.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.786 HD13 ' CE1' ' A' ' 400' ' ' PHE . 10.0 tp -61.28 -46.85 88.64 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.33 -31.9 69.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.657 177.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' A' ' 410' ' ' TRP . 0.4 OUTLIER -63.38 -44.6 94.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.959 -179.166 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 6.3 ptp -66.29 -36.9 84.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.071 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.471 HD12 ' O ' ' A' ' 416' ' ' LEU . 8.5 tp -68.69 -41.91 78.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.493 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -32.83 73.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.843 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.55 -47.19 76.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.522 ' CD ' HD13 ' A' ' 393' ' ' LEU . 15.3 pt-20 -66.29 -40.3 89.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.902 0.382 . . . . 0.0 110.704 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.853 HD22 HD11 ' A' ' 423' ' ' LEU . 1.0 OUTLIER -66.46 -33.58 76.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.094 0.473 . . . . 0.0 110.381 179.561 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.64 -31.79 68.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.102 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -46.52 73.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.32 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 1.03 HD22 ' HB1' ' A' ' 441' ' ' ALA . 3.3 pp -65.24 -31.18 72.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.339 . . . . 0.0 110.939 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . 0.625 ' N ' HD12 ' A' ' 423' ' ' LEU . 12.4 t70 -70.09 -26.82 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 1.8 t -57.96 -25.92 61.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.159 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 23.7 t -66.63 134.86 29.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.89 0.376 . . . . 0.0 111.098 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -101.82 -177.79 3.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 10.2 t -151.13 138.38 19.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.86 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -100.87 28.27 16.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.547 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 97.16 43.68 2.97 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.467 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.695 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.3 mm-40 -116.43 129.05 56.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.862 0.363 . . . . 0.0 110.831 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -67.19 -37.45 83.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.34 -43.93 95.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.817 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.695 HG23 ' HB3' ' A' ' 431' ' ' GLN . 29.4 t -60.64 -46.1 96.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.08 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -34.3 74.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.782 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -64.71 -34.31 78.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.829 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -70.56 -43.64 69.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.155 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.776 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.3 mmp_? -61.89 -44.53 96.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.924 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.49 -43.09 99.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.012 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.45 -45.0 95.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.074 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 1.03 ' HB1' HD22 ' A' ' 423' ' ' LEU . . . -70.88 -45.58 64.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.319 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 438' ' ' ARG . 38.5 t -69.37 -30.7 46.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.025 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 54.1 t -70.66 -43.09 69.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.78 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.83 -44.58 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.062 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.85 HG12 HD23 ' A' ' 420' ' ' LEU . 2.8 pp -63.27 -31.12 51.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.765 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.609 ' N ' HD12 ' A' ' 445' ' ' ILE . 5.8 tp-100 -64.48 -46.57 82.48 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.631 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -58.97 -36.79 75.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.682 HG22 HG11 ' A' ' 397' ' ' VAL . 24.4 mt -66.78 -36.53 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.9 tt -57.64 -58.71 7.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.813 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.94 -38.05 81.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.415 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.4 mmpp? -57.94 -29.88 65.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.636 ' HG ' HD23 ' A' ' 412' ' ' LEU . 0.2 OUTLIER -71.33 -38.86 71.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.525 179.311 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.68 -29.98 65.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.121 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -20.7 23.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -20.6 36.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.768 0.318 . . . . 0.0 110.981 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.46 -90.33 0.18 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.329 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 112.447 -0.261 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.425 ' CB ' ' HD3' ' A' ' 373' ' ' PRO . 0.5 OUTLIER -72.44 -51.51 7.41 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.63 0.252 . . . . 0.0 110.958 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . 0.425 ' HD3' ' CB ' ' A' ' 372' ' ' SER . 21.8 Cg_exo -64.84 82.4 0.18 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.603 2.202 . . . . 0.0 112.146 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 60.77 157.82 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.75 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -117.37 -60.73 1.79 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.856 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -104.17 142.59 24.92 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.788 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.583 ' CG ' HD13 ' A' ' 380' ' ' ILE . 35.0 Cg_exo -59.56 -175.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.356 2.037 . . . . 0.0 111.947 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.416 ' CD ' ' CB ' ' A' ' 377' ' ' PRO . 74.5 Cg_endo -90.43 10.72 2.87 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.722 2.281 . . . . 0.0 113.579 -179.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -124.66 -29.94 3.38 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.956 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.662 HG22 HD11 ' A' ' 384' ' ' ILE . 1.7 mp -58.6 -29.58 39.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.443 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.8 OUTLIER -56.94 -33.85 67.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.252 -179.517 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -68.43 -38.11 80.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.127 0.489 . . . . 0.0 110.827 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.691 HG13 HG13 ' A' ' 434' ' ' VAL . 40.7 mm -60.52 -33.98 56.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.524 178.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.662 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.94 -44.78 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.584 178.582 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . 0.415 ' CG ' ' N ' ' A' ' 386' ' ' VAL . 0.0 OUTLIER -59.26 -49.47 77.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.511 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.904 HG21 ' HG ' ' A' ' 423' ' ' LEU . 14.7 p -64.0 -43.5 97.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.59 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.448 ' N ' HG13 ' A' ' 386' ' ' VAL . 2.2 tt -60.7 -34.43 74.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.384 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 3.2 mt-10 -62.8 -35.01 78.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.519 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 -34.48 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.55 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.452 HG13 HG22 ' A' ' 445' ' ' ILE . 22.5 t -61.63 -46.85 95.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.488 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.6 pt20 -64.98 -35.51 81.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.836 0.35 . . . . 0.0 110.797 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -40.8 74.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.632 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.545 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.5 OUTLIER -64.0 -41.7 97.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.618 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.21 -38.54 83.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.22 -35.34 80.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.826 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -69.27 -39.9 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 393' ' ' LEU . 23.5 t -60.71 -44.85 98.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.028 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -55.76 -40.32 72.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 400' ' ' PHE . 15.3 tt0 -78.19 -53.93 6.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.304 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.604 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 35.1 t80 -22.65 123.28 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.09 -0.959 . . . . 0.0 113.145 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 401' ' ' VAL . 11.6 p -118.33 24.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.444 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.604 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -61.09 -169.37 0.58 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.941 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.556 ' HB2' ' HB2' ' A' ' 406' ' ' ASP . 0.3 OUTLIER -133.7 143.64 48.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.498 . . . . 0.0 111.17 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.406 ' N ' ' HA3' ' A' ' 456' ' ' GLY . 0.2 OUTLIER -50.16 -27.99 6.7 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.593 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.87 11.99 19.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 29.8 t70 -93.5 154.61 17.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 110.963 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -32.72 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.557 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -63.0 -45.9 90.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.897 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.556 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 11.8 t80 -61.34 -44.53 97.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.919 0.39 . . . . 0.0 110.672 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.481 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -59.13 -48.65 80.84 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 1.2 tp -65.01 -38.47 91.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.76 HD12 HD13 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.04 -47.43 86.43 Favored 'General case' 0 C--N 1.339 0.113 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -70.68 -32.29 69.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.572 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.6 mt-10 -63.7 -39.65 94.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.838 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 1.6 ttt -69.45 -42.01 75.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.959 0.409 . . . . 0.0 110.167 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.69 HD12 HD12 ' A' ' 449' ' ' LEU . 0.9 OUTLIER -61.04 -40.41 93.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.549 179.548 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.578 ' HA ' HD21 ' A' ' 420' ' ' LEU . 2.7 m -64.13 -32.97 74.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.446 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.725 ' HA ' HD12 ' A' ' 421' ' ' LEU . 0.3 OUTLIER -73.12 -23.58 60.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.891 ' HG2' HG21 ' A' ' 445' ' ' ILE . 0.4 OUTLIER -72.81 -46.64 52.08 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.056 -179.748 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.812 ' HB2' HG13 ' A' ' 442' ' ' VAL . 0.8 OUTLIER -64.79 -50.19 67.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.242 -178.965 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.981 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -64.29 -31.38 72.57 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.176 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . 0.981 ' N ' HD13 ' A' ' 421' ' ' LEU . 5.3 tp10 -64.25 -38.77 92.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.904 ' HG ' HG21 ' A' ' 386' ' ' VAL . 0.4 OUTLIER -73.83 -31.19 63.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.007 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -74.16 -28.15 61.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.966 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 83.1 p -98.69 39.73 1.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 423' ' ' LEU . 23.8 t -101.07 136.74 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.35 138.8 58.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.9 p -153.94 163.7 39.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.925 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -173.75 98.67 0.13 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.17 49.74 55.7 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.466 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.462 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.8 mt-30 -147.76 87.25 1.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.838 0.351 . . . . 0.0 110.952 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -64.58 -33.88 76.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.928 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 9.5 m -60.54 -44.74 95.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.923 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.691 HG13 HG13 ' A' ' 383' ' ' ILE . 32.6 t -66.53 -36.13 76.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.44 -39.15 85.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.861 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -69.1 -32.93 72.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.951 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.82 -45.23 62.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.237 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -62.23 -31.53 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.56 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -67.97 -37.52 81.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.885 ' HB3' HD22 ' A' ' 423' ' ' LEU . . . -61.87 -45.66 92.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.865 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.812 HG13 ' HB2' ' A' ' 420' ' ' LEU . 57.8 t -66.99 -36.31 76.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 16.0 m -70.9 -46.77 61.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.658 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -44.57 89.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.892 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.891 HG21 ' HG2' ' A' ' 419' ' ' GLU . 2.8 pp -63.21 -31.36 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.191 0.52 . . . . 0.0 110.294 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.545 ' N ' HD12 ' A' ' 445' ' ' ILE . 4.8 tp-100 -59.09 -47.73 84.19 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.586 179.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.13 -37.41 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.335 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.48 ' CG2' HG21 ' A' ' 397' ' ' VAL . 41.9 mt -69.08 -36.36 73.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.594 179.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.69 HD12 HD12 ' A' ' 416' ' ' LEU . 6.2 tt -57.49 -47.28 82.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.66 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -37.84 88.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.246 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -30.14 65.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.803 178.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.76 HD13 HD12 ' A' ' 412' ' ' LEU . 4.8 tp -73.09 -36.69 66.84 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.291 179.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -57.07 -29.92 63.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.477 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm -92.85 -12.45 31.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.29 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -25.48 33.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.925 0.393 . . . . 0.0 110.361 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.406 ' HA3' ' N ' ' A' ' 404' ' ' LYS . . . -76.41 -70.19 1.31 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.459 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.946 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 60.18 160.03 0.11 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.717 0.294 . . . . 0.0 110.933 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.1 171.64 14.45 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.563 2.175 . . . . 0.0 112.335 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -136.02 120.21 17.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.859 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -119.4 -72.25 0.7 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.435 ' HA ' ' HD3' ' A' ' 377' ' ' PRO . 2.8 m -105.52 133.67 20.06 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.885 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.449 ' HD2' HG13 ' A' ' 380' ' ' ILE . 32.4 Cg_exo -58.74 171.56 1.97 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.466 2.111 . . . . 0.0 112.294 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -78.38 -29.05 4.11 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 123.079 2.519 . . . . 0.0 112.952 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 29.1 t -90.15 -26.24 20.28 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.718 ' HA ' HD12 ' A' ' 383' ' ' ILE . 33.5 mm -58.76 -29.7 40.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.471 ' HA ' HG12 ' A' ' 384' ' ' ILE . 4.0 mtpt -57.03 -33.19 66.95 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.019 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.535 ' O ' HG23 ' A' ' 386' ' ' VAL . 17.2 mttt -66.7 -38.05 85.97 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.196 0.522 . . . . 0.0 110.841 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.718 HD12 ' HA ' ' A' ' 380' ' ' ILE . 18.9 mt -60.5 -35.74 65.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.308 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.639 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -75.03 -44.65 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.592 178.53 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -58.08 -49.38 77.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.893 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.548 HG11 ' HB3' ' A' ' 423' ' ' LEU . 41.1 t -69.23 -46.09 78.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.079 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.16 -36.46 81.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.941 0.4 . . . . 0.0 110.502 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.82 -34.76 77.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.739 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -36.36 74.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.785 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.796 HG22 ' CD ' ' A' ' 419' ' ' GLU . 15.6 t -66.84 -46.75 84.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.063 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.407 ' HG3' ' N ' ' A' ' 392' ' ' TYR . 12.4 pt20 -61.79 -37.5 84.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.627 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.407 ' N ' ' HG3' ' A' ' 391' ' ' GLN . 15.3 t80 -72.4 -47.98 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.807 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.41 ' HB3' HD22 ' A' ' 416' ' ' LEU . 4.4 mt -60.73 -39.36 88.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . 0.406 ' OE1' HD11 ' A' ' 448' ' ' ILE . 47.9 tt0 -61.3 -40.66 94.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.751 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -31.83 73.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.737 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -68.79 -40.37 79.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.792 HG21 ' CG2' ' A' ' 448' ' ' ILE . 30.3 t -60.64 -40.13 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.784 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.58 -37.0 70.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.119 0.485 . . . . 0.0 110.371 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -83.57 -54.38 4.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.254 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.679 ' CE1' HD23 ' A' ' 412' ' ' LEU . 51.2 t80 -27.69 109.18 0.04 OUTLIER 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.023 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 401' ' ' VAL . 20.4 t -102.36 26.36 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.298 178.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.629 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -56.3 -175.91 0.25 Allowed Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.118 -179.269 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.496 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.66 48.25 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.819 -0.69 . . . . 0.0 111.511 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.444 ' HG2' ' CZ ' ' A' ' 409' ' ' TYR . 0.9 OUTLIER -53.5 -26.3 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.423 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 7.9 t -94.95 -15.48 23.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.552 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.454 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 9.2 t70 -77.44 142.29 39.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.78 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 46.2 mttm -61.71 -30.41 70.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.636 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.07 -29.08 70.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.728 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 24.3 t80 -67.77 -45.46 74.83 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.78 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.2 p-90 -72.73 -29.34 63.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.056 178.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.616 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 6.1 tp -69.54 -40.39 76.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.158 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.721 HD12 HD21 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -59.68 -46.96 87.49 Favored 'General case' 0 C--N 1.339 0.141 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.823 ' HG2' HD22 ' A' ' 452' ' ' LEU . 1.2 mt-10 -70.09 -31.52 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.521 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.6 OUTLIER -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.018 -179.181 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 3.0 mmt -69.49 -39.74 77.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.217 0.532 . . . . 0.0 109.896 178.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 1.067 HD12 HG23 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -60.6 -42.72 97.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.881 179.962 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.559 HG22 HD13 ' A' ' 421' ' ' LEU . 3.2 m -65.92 -32.72 74.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.689 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -47.21 84.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.569 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.796 ' CD ' HG22 ' A' ' 390' ' ' VAL . 0.0 OUTLIER -63.55 -34.55 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 423' ' ' LEU . 0.4 OUTLIER -68.88 -41.2 78.66 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.916 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.559 HD13 HG22 ' A' ' 417' ' ' THR . 5.5 mp -70.75 -31.87 68.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.328 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 -46.55 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.943 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.548 ' HB3' HG11 ' A' ' 386' ' ' VAL . 3.1 pp -58.81 -30.7 67.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.743 0.306 . . . . 0.0 111.261 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -91.75 31.77 1.18 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.371 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.34 -17.58 8.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.446 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 28.4 m -66.59 137.87 24.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.792 0.33 . . . . 0.0 111.386 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -87.73 86.47 7.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 5.5 p -84.22 131.99 34.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.795 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -93.19 -76.38 1.33 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.532 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -131.61 44.52 1.2 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.415 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.412 ' HB3' HG23 ' A' ' 434' ' ' VAL . 2.9 mt-30 -106.99 92.54 4.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.825 0.345 . . . . 0.0 110.883 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -67.55 -40.39 84.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.989 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 76.6 p -58.66 -44.88 90.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.852 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.412 HG23 ' HB3' ' A' ' 431' ' ' GLN . 43.5 t -64.43 -39.89 87.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.981 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -58.88 -42.8 90.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -36.68 83.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.639 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.56 -40.61 95.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.547 ' HB3' HD13 ' A' ' 423' ' ' LEU . 0.0 OUTLIER -66.79 -44.3 81.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 6.9 mtpp -55.98 -35.25 66.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 110.629 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.05 -32.0 64.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.743 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.56 72.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.071 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.464 HG13 HD21 ' A' ' 420' ' ' LEU . 42.5 t -62.96 -39.21 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.728 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -38.56 85.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.517 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -35.45 80.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.353 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 1.067 HG23 HD12 ' A' ' 416' ' ' LEU . 2.5 mm -65.78 -31.2 52.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.707 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -44.45 85.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.442 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.62 -38.44 91.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.839 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.86 ' O ' HD12 ' A' ' 452' ' ' LEU . 15.9 mt -74.67 -36.29 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.878 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.573 HD12 HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.2 -51.64 68.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.675 -179.776 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.47 -33.99 77.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 0.0 110.098 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -59.65 -31.71 69.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.848 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.86 HD12 ' O ' ' A' ' 448' ' ' ILE . 0.4 OUTLIER -73.14 -36.61 66.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.448 179.265 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.21 -30.0 61.72 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.974 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -13.57 23.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.367 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -82.06 -26.26 33.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.171 0.51 . . . . 0.0 110.916 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -85.66 -97.97 0.74 Allowed Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.598 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.848 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.119 0 N-CA-C 112.511 -0.235 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -159.95 156.32 23.78 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.744 0.307 . . . . 0.0 110.826 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.15 177.09 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.524 2.149 . . . . 0.0 112.262 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -156.56 153.26 28.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.831 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . 0.403 ' CD2' ' OG1' ' A' ' 376' ' ' THR . 8.2 p90 -125.74 179.79 5.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.866 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.403 ' OG1' ' CD2' ' A' ' 375' ' ' PHE . 0.3 OUTLIER 62.56 105.38 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.828 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.418 ' HB2' HG12 ' A' ' 380' ' ' ILE . 51.2 Cg_exo -53.67 168.37 0.76 Allowed 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.46 2.107 . . . . 0.0 112.3 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -75.53 -22.0 14.35 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.99 2.46 . . . . 0.0 112.985 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 1.3 m -98.61 -26.58 14.34 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.868 ' O ' HG22 ' A' ' 383' ' ' ILE . 30.6 mm -58.67 -29.9 40.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.79 -33.26 66.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.865 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -65.82 -41.16 92.16 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.325 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.868 HG22 ' O ' ' A' ' 380' ' ' ILE . 5.4 tp -60.68 -32.41 51.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.573 HD13 HG23 ' A' ' 383' ' ' ILE . 0.3 OUTLIER -75.02 -44.78 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.714 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.98 -49.36 75.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.882 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.462 ' O ' HG23 ' A' ' 390' ' ' VAL . 10.4 p -63.87 -37.34 79.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.861 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.4 tp -67.56 -37.73 83.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.67 -34.67 77.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.744 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -44.58 78.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 386' ' ' VAL . 29.0 t -63.25 -35.95 74.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.136 0.493 . . . . 0.0 110.384 179.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.32 -41.06 88.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.486 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.95 -42.87 99.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.303 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.637 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.0 OUTLIER -58.4 -38.08 76.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.447 179.501 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . 0.71 ' OE1' HD11 ' A' ' 448' ' ' ILE . 15.2 tt0 -59.37 -42.69 92.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.1 -41.1 82.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.779 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 49.3 mm-40 -69.27 -44.51 71.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.971 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.791 HG11 HG22 ' A' ' 448' ' ' ILE . 45.5 t -60.59 -33.45 54.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.532 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -57.01 -34.78 68.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.993 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.0 tt0 -89.99 -67.46 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.764 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.851 ' CD1' HD22 ' A' ' 412' ' ' LEU . 8.2 t80 43.4 111.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.805 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . . . . . . . . . 9.8 m -95.76 23.6 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.157 178.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.526 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -91.69 -171.46 42.26 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.582 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.455 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.07 143.77 48.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.685 0.279 . . . . 0.0 111.666 -179.696 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.528 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.1 OUTLIER -54.94 -25.56 30.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.214 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.05 0.37 37.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.436 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -92.14 149.5 21.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.34 . . . . 0.0 110.635 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.783 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.14 -30.16 70.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.852 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.82 -29.17 70.52 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.103 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.528 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 2.3 t80 -69.57 -45.56 68.41 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.783 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 4.8 p-90 -72.85 -30.99 64.45 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.961 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.619 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 36.6 tp -69.67 -38.4 77.03 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.471 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.851 HD22 ' CD1' ' A' ' 400' ' ' PHE . 11.2 tp -61.66 -47.34 85.81 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.86 ' CG ' HD13 ' A' ' 452' ' ' LEU . 24.7 mt-10 -70.41 -32.7 70.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.304 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.619 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 3.8 mt-10 -64.01 -35.67 81.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.442 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . . . . . . . . . 28.3 ttp -69.6 -40.66 76.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.653 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.835 HD21 HG21 ' A' ' 448' ' ' ILE . 1.9 mp -60.62 -45.74 92.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.69 -33.45 75.11 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.643 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -59.41 -47.27 86.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.358 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -69.75 -38.11 76.67 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.501 HD13 HG13 ' A' ' 445' ' ' ILE . 27.9 tp -61.35 -39.47 90.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.247 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.34 -31.84 69.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.782 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -46.21 91.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.781 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.24 -35.07 77.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.824 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.12 -31.26 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.803 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.8 t -60.31 -20.79 60.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 22.7 t -66.49 116.77 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.087 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.54 113.72 25.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.959 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 7.4 t -107.87 133.21 52.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -96.24 34.64 4.82 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.482 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 108.69 69.94 0.67 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.426 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.662 ' HG2' HG23 ' A' ' 434' ' ' VAL . 3.0 tt0 -143.19 114.5 7.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.937 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -65.81 -35.27 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 42.2 t -60.14 -44.66 94.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.662 HG23 ' HG2' ' A' ' 431' ' ' GLN . 27.8 t -71.13 -42.89 75.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.995 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -67.78 -35.5 78.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.09 -35.26 76.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.853 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.13 76.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.136 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.0 OUTLIER -68.63 -43.86 75.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.935 179.971 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -59.04 -44.83 91.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.767 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -62.48 -36.28 82.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.645 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.42 76.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.002 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 438' ' ' ARG . 34.2 t -63.11 -45.9 97.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.051 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.91 -34.56 74.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.083 0.468 . . . . 0.0 110.322 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -63.18 -35.74 81.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.339 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.58 ' HA ' HD12 ' A' ' 448' ' ' ILE . 2.6 mm -66.13 -35.51 75.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.473 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -58.25 -47.78 82.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.089 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -65.63 -37.07 85.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.966 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.835 HG21 HD21 ' A' ' 416' ' ' LEU . 7.8 mt -74.78 -36.5 40.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.144 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.535 ' CD1' HG22 ' A' ' 445' ' ' ILE . 0.1 OUTLIER -57.39 -54.11 50.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.926 -179.473 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -38.62 91.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.354 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . 0.454 ' O ' ' HD2' ' A' ' 455' ' ' LYS . 3.7 mttm -57.87 -35.19 70.64 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.86 HD13 ' CG ' ' A' ' 413' ' ' GLU . 0.2 OUTLIER -66.46 -36.76 83.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.397 179.071 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.7 -29.91 70.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.789 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.71 -16.25 25.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.845 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.454 ' HD2' ' O ' ' A' ' 451' ' ' LYS . 0.3 OUTLIER -82.46 -22.6 35.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.797 0.332 . . . . 0.0 110.776 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.08 -79.77 0.67 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.374 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.401 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 20.6 p -139.17 63.67 30.37 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.832 0.349 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.21 173.06 0.24 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.566 2.178 . . . . 0.0 112.293 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -115.67 -83.48 0.62 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.97 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 62.61 -80.43 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.019 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.587 HG22 ' HD2' ' A' ' 377' ' ' PRO . 0.2 OUTLIER -137.1 142.78 39.44 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.649 -179.959 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.587 ' HD2' HG22 ' A' ' 376' ' ' THR . 78.8 Cg_exo -49.94 178.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.478 2.118 . . . . 0.0 112.597 -179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -80.43 -23.29 6.2 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 123.238 2.626 . . . . 0.0 113.484 -178.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 96.7 p -106.32 -26.27 11.57 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.764 HG22 HD11 ' A' ' 384' ' ' ILE . 46.0 mm -58.65 -29.81 40.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 178.489 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.438 ' HA ' HG12 ' A' ' 384' ' ' ILE . 0.1 OUTLIER -57.09 -33.35 67.21 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.052 -179.84 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . 0.705 ' O ' HG23 ' A' ' 386' ' ' VAL . 47.4 mttt -68.25 -38.21 81.55 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.099 0.476 . . . . 0.0 110.873 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.761 HD12 ' HA ' ' A' ' 380' ' ' ILE . 21.6 mt -60.54 -34.98 60.35 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.399 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.764 HD11 HG22 ' A' ' 380' ' ' ILE . 0.2 OUTLIER -74.97 -44.72 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.426 178.615 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.04 -49.32 76.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.768 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.8 ' HB ' HD21 ' A' ' 423' ' ' LEU . 19.9 t -67.06 -39.34 83.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.012 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 4.2 tt -67.13 -35.65 80.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.474 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 2.2 tt0 -62.71 -34.72 77.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.672 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.02 -34.6 73.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.424 179.704 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 386' ' ' VAL . 32.6 t -67.7 -46.87 81.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.096 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 14.4 pt20 -59.46 -41.03 88.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.946 0.403 . . . . 0.0 110.538 179.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.37 -37.39 77.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.231 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.799 HD21 ' HG2' ' A' ' 415' ' ' MET . 0.4 OUTLIER -64.97 -38.66 91.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.381 179.484 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . 0.488 ' HB2' HD11 ' A' ' 448' ' ' ILE . 7.3 tt0 -59.11 -45.07 91.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.461 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -60.98 -33.52 73.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.631 179.562 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.25 -40.7 77.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.813 179.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.932 HG21 ' CG2' ' A' ' 448' ' ' ILE . 24.4 t -60.68 -33.27 54.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.472 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -28.51 64.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.174 0.512 . . . . 0.0 110.135 178.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 400' ' ' PHE . 24.3 tt0 -91.69 -53.39 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.886 179.119 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.675 ' CZ ' ' HA3' ' A' ' 402' ' ' GLY . 46.1 t80 -20.78 112.64 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.231 179.823 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.8 p -104.07 26.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.619 178.243 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.675 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -58.91 -177.66 0.93 Allowed Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.781 -0.724 . . . . 0.0 113.065 -179.309 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.518 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.01 143.62 48.22 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.834 -0.683 . . . . 0.0 111.543 -179.999 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -52.56 -27.15 15.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.319 179.355 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.5 -15.55 20.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.493 -179.707 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -74.52 144.17 44.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.763 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.1 OUTLIER -62.81 -30.83 71.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.813 179.894 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.09 70.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.803 179.565 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.518 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 41.2 t80 -68.36 -45.58 72.43 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.763 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 1.2 p-90 -72.94 -29.37 63.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 118.747 -1.181 . . . . 0.0 108.949 177.921 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.62 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 20.2 tp -69.61 -38.43 77.26 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.14 177.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.733 HD12 HD21 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -61.69 -47.32 85.86 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.906 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.449 ' HG3' HD13 ' A' ' 452' ' ' LEU . 3.7 tt0 -70.63 -32.26 69.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.646 177.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.87 -38.97 93.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.198 -179.367 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.799 ' HG2' HD21 ' A' ' 393' ' ' LEU . 50.3 ttp -69.64 -44.79 69.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.339 . . . . 0.0 110.859 -179.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.876 HD12 ' N ' ' A' ' 417' ' ' THR . 4.4 pp -69.49 -37.11 77.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.505 179.641 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.876 ' N ' HD12 ' A' ' 416' ' ' LEU . 1.2 t -70.26 -44.28 68.77 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 415' ' ' MET . 0.0 OUTLIER -61.68 -38.61 88.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.726 0.298 . . . . 0.0 110.931 -179.627 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 420' ' ' LEU . 18.0 pt-20 -72.27 -46.33 56.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.11 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.755 ' CB ' HG21 ' A' ' 445' ' ' ILE . 1.7 pp -66.61 -34.29 77.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.5 -38.44 89.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.937 179.249 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.89 -44.3 97.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.298 179.51 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.8 HD21 ' HB ' ' A' ' 386' ' ' VAL . 82.1 mt -67.06 -38.08 85.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.708 179.582 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.04 -26.47 65.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.009 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 4.3 p -96.8 38.33 1.23 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.931 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 10.9 p -88.92 133.53 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.45 98.68 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 1.8 t -114.22 129.55 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.947 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -158.46 100.06 0.19 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.462 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 66.21 49.89 54.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.458 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.504 ' O ' HG12 ' A' ' 434' ' ' VAL . 32.4 mt-30 -152.2 108.63 3.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.867 0.365 . . . . 0.0 110.926 179.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.69 -28.82 68.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 6.5 m -59.8 -44.93 93.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.724 -179.34 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 431' ' ' GLN . 10.8 p -72.44 -35.25 51.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 111.328 -179.588 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -42.44 94.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.803 0.335 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -69.29 -32.88 72.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.503 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -71.43 -45.23 63.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.199 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 442' ' ' VAL . 1.2 ptt85 -68.36 -35.08 77.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.775 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -66.24 -35.79 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.793 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.6 -45.42 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.23 95.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 438' ' ' ARG . 24.5 t -63.33 -31.34 52.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.83 -46.7 62.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.98 179.774 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -67.01 -44.69 79.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.218 -179.796 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.755 HG21 ' CB ' ' A' ' 420' ' ' LEU . 2.0 pp -63.3 -31.08 51.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.98 0.419 . . . . 0.0 110.937 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.09 -44.62 91.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.584 179.692 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.13 77.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.284 -179.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.932 ' CG2' HG21 ' A' ' 397' ' ' VAL . 22.0 mt -73.3 -36.59 49.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.174 -179.9 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.57 -57.64 11.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.026 -179.768 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -33.18 74.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.744 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -31.88 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.976 0.417 . . . . 0.0 110.365 179.6 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.733 HD21 HD12 ' A' ' 412' ' ' LEU . 2.7 mt -77.61 -36.63 51.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.796 179.619 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -56.04 -30.01 61.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.769 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -90.35 -22.43 21.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.737 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -19.2 39.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.031 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -76.03 -98.9 0.14 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.483 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.89 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 60.3 m -81.38 147.63 60.68 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.67 0.271 . . . . 0.0 110.843 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.27 -50.88 12.43 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.594 2.196 . . . . 0.0 112.384 179.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 60.09 109.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.88 -179.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -92.45 -75.9 0.47 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.129 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.21 96.91 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.676 -179.831 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.608 ' HG2' HG13 ' A' ' 380' ' ' ILE . 44.7 Cg_exo -59.27 155.85 38.32 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.568 2.178 . . . . 0.0 112.268 -179.701 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 377' ' ' PRO . 5.9 Cg_exo -78.51 -10.64 15.92 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.935 2.423 . . . . 0.0 113.354 -179.158 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 10.7 p -114.73 -27.88 7.3 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 120.675 -0.41 . . . . 0.0 112.025 -179.356 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.608 HG13 ' HG2' ' A' ' 377' ' ' PRO . 33.2 mm -58.6 -29.76 40.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.547 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.429 ' HA ' HG12 ' A' ' 384' ' ' ILE . 24.6 mttt -59.35 -33.32 71.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.811 179.737 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -68.09 -38.07 81.93 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.246 0.546 . . . . 0.0 110.764 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.571 HD12 HG13 ' A' ' 434' ' ' VAL . 40.1 mm -60.48 -33.95 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.477 178.945 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.557 ' N ' HD13 ' A' ' 384' ' ' ILE . 0.4 OUTLIER -74.94 -44.49 44.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.169 178.293 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -56.82 -45.98 81.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.696 179.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.453 HG13 ' N ' ' A' ' 387' ' ' LEU . 13.5 p -69.36 -44.16 80.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.923 179.695 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.941 ' O ' HG12 ' A' ' 390' ' ' VAL . 0.3 OUTLIER -66.12 -35.11 79.62 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.745 179.87 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.81 -34.98 78.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.304 0.573 . . . . 0.0 109.526 178.784 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -67.16 -40.78 86.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.591 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.941 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -63.17 -35.62 72.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.817 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.22 -41.07 99.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.816 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -64.23 -44.96 90.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.515 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -58.69 -40.6 84.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.986 179.962 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -60.15 -39.44 86.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.944 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -36.24 82.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.132 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.48 -40.62 85.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.093 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.86 HG21 HG21 ' A' ' 448' ' ' ILE . 18.1 t -60.68 -39.19 80.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 179.891 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.65 -40.37 75.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.979 0.418 . . . . 0.0 110.388 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.473 ' O ' ' C ' ' A' ' 400' ' ' PHE . 17.6 tt0 -77.34 -54.86 5.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.169 179.35 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.557 ' CE1' HD23 ' A' ' 412' ' ' LEU . 41.8 t80 -11.76 110.92 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.525 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.628 HG22 ' O ' ' A' ' 401' ' ' VAL . 13.5 p -104.49 24.92 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.515 178.193 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.524 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -64.4 -169.05 1.71 Allowed Glycine 0 N--CA 1.442 -0.925 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.873 -179.347 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.59 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -133.86 143.55 48.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.351 -0.424 . . . . 0.0 111.253 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.629 ' HG2' HD23 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -52.79 -24.07 8.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.781 179.853 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . 0.401 HG23 ' HD2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER -105.02 -5.03 21.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.521 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.563 ' OD2' ' HB3' ' A' ' 408' ' ' ALA . 24.3 t70 -77.84 156.13 30.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.788 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 41.0 mtmt -68.97 -32.87 72.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.292 179.587 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.563 ' HB3' ' OD2' ' A' ' 406' ' ' ASP . . . -62.83 -29.2 70.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 178.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 403' ' ' LYS . 19.8 t80 -63.04 -45.23 93.23 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.827 -179.118 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.788 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 0.6 OUTLIER -72.62 -27.91 62.44 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 118.763 -1.175 . . . . 0.0 108.74 177.83 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.677 HD12 ' CE3' ' A' ' 410' ' ' TRP . 1.7 mp -66.48 -41.53 88.84 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.28 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.826 HD12 HD13 ' A' ' 452' ' ' LEU . 0.2 OUTLIER -59.82 -46.78 88.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.813 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.403 ' CG ' ' CD2' ' A' ' 449' ' ' LEU . 2.1 tm-20 -70.23 -31.94 69.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.593 177.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.552 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.0 OUTLIER -63.49 -42.22 98.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.339 -179.059 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 411' ' ' LEU . 4.1 mmt -69.53 -44.33 71.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.078 0.466 . . . . 0.0 110.622 179.622 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.571 HD21 HG21 ' A' ' 397' ' ' VAL . 4.3 mt -61.68 -44.34 97.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 23.7 m -62.58 -30.46 71.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 -179.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.67 ' HA ' HD12 ' A' ' 421' ' ' LEU . 14.7 mttt -64.31 -43.39 94.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.062 0.458 . . . . 0.0 110.261 179.42 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.562 ' O ' HD23 ' A' ' 423' ' ' LEU . 1.0 OUTLIER -72.73 -37.78 67.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.991 179.178 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.912 ' HG ' HG13 ' A' ' 442' ' ' VAL . 0.3 OUTLIER -66.86 -50.51 62.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.385 -179.812 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.982 HD13 ' N ' ' A' ' 422' ' ' GLU . 0.0 OUTLIER -70.33 -31.5 68.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.986 -179.567 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . 0.982 ' N ' HD13 ' A' ' 421' ' ' LEU . 0.8 OUTLIER -59.64 -46.34 89.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.781 0.324 . . . . 0.0 110.883 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.604 ' HG ' ' HB3' ' A' ' 441' ' ' ALA . 4.3 mm? -65.4 -31.02 71.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.991 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.07 -0.82 41.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.535 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 33.8 p -79.51 -37.25 37.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.825 0.345 . . . . 0.0 110.971 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 27.6 m -74.21 133.77 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.166 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -86.56 -22.22 26.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.069 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 2.5 t 43.53 85.52 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.525 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -97.21 46.98 1.64 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.449 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 144.92 52.57 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.465 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.737 ' HG2' HG23 ' A' ' 434' ' ' VAL . 0.0 OUTLIER -164.14 95.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.86 0.362 . . . . 0.0 110.912 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -65.87 -33.93 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.867 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 27.9 t -59.15 -37.45 77.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.737 HG23 ' HG2' ' A' ' 431' ' ' GLN . 30.8 t -74.43 -41.9 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.088 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -44.25 93.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -67.47 -35.76 79.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.046 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.408 ' CB ' ' CG2' ' A' ' 383' ' ' ILE . . . -73.11 -45.12 58.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.471 -179.767 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.764 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.1 OUTLIER -66.17 -40.11 90.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.947 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -36.12 82.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.707 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.06 -42.82 62.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.811 179.784 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . 0.697 ' HB2' ' CD2' ' A' ' 387' ' ' LEU . . . -62.01 -45.56 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.912 HG13 ' HG ' ' A' ' 420' ' ' LEU . 43.2 t -65.11 -46.04 92.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.966 0.412 . . . . 0.0 110.813 179.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 8.7 m -61.97 -35.14 77.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.522 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.1 -38.03 89.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.389 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.671 ' HA ' HD12 ' A' ' 448' ' ' ILE . 1.5 mp -67.08 -31.32 52.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.485 ' HA ' HD12 ' A' ' 449' ' ' LEU . 6.8 tp-100 -63.05 -45.79 90.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.712 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.5 -37.62 85.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.86 HG21 HG21 ' A' ' 397' ' ' VAL . 10.1 mt -70.34 -36.41 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.805 179.699 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 446' ' ' GLN . 20.0 mt -57.19 -50.22 73.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.63 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.42 -41.85 75.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.831 0.348 . . . . 0.0 110.123 179.318 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.83 -30.04 65.44 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.544 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.826 HD13 HD12 ' A' ' 412' ' ' LEU . 11.4 tp -71.25 -36.64 71.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.323 179.249 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -56.31 -29.93 61.9 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.587 179.45 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -89.91 -17.13 28.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.904 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -22.41 35.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.717 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -74.09 -81.61 0.43 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.151 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.629 HD23 ' HG2' ' A' ' 404' ' ' LYS . 2.5 pp . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.947 179.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 23.0 t -60.69 110.35 2.85 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.504 0.192 . . . . 0.0 111.016 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.48 90.1 1.23 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.453 2.102 . . . . 0.0 112.309 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -67.43 110.5 3.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.901 179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -111.35 99.16 8.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.23 151.67 43.29 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.808 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.588 ' HD2' HD12 ' A' ' 380' ' ' ILE . 78.1 Cg_exo -51.35 -177.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.667 2.245 . . . . 0.0 112.393 179.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -87.98 -12.21 4.29 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.771 2.314 . . . . 0.0 113.467 -179.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 2.9 p -115.94 -21.57 9.45 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.502 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.588 HD12 ' HD2' ' A' ' 377' ' ' PRO . 3.2 mt -58.82 -30.11 41.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.609 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.444 ' HA ' HG12 ' A' ' 384' ' ' ILE . 6.5 mmmt -57.04 -33.23 67.01 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.867 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -38.09 83.69 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.154 0.502 . . . . 0.0 110.808 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.798 HG21 ' HB1' ' A' ' 437' ' ' ALA . 39.4 mm -60.44 -34.33 57.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.445 178.884 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.481 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.86 -44.72 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.396 178.517 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -57.37 -49.1 77.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.573 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.798 HG11 ' HG ' ' A' ' 423' ' ' LEU . 78.1 t -65.97 -40.74 88.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.824 179.634 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.925 ' O ' HG12 ' A' ' 390' ' ' VAL . 3.2 tt -66.01 -35.06 79.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.906 0.384 . . . . 0.0 110.622 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -34.97 78.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -67.75 -39.54 84.17 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.604 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.925 HG12 ' O ' ' A' ' 387' ' ' LEU . 4.3 p -64.48 -35.57 74.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.483 179.635 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -41.02 97.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.349 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -67.81 -46.52 71.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.491 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.91 ' O ' HG23 ' A' ' 397' ' ' VAL . 42.7 mt -62.11 -37.97 87.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.487 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -37.36 79.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.645 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -64.04 -42.39 97.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.606 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -69.04 -40.19 78.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.715 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.91 HG23 ' O ' ' A' ' 393' ' ' LEU . 22.1 t -60.6 -36.71 72.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.672 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.61 -35.75 66.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.175 0.512 . . . . 0.0 110.107 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.8 tt0 -90.07 -66.83 0.89 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.813 178.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.924 ' CE1' HD13 ' A' ' 412' ' ' LEU . 9.6 t80 31.21 108.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 179.292 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.59 ' O ' HG12 ' A' ' 401' ' ' VAL . 17.4 t -95.49 25.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.165 178.177 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.564 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -87.03 -174.83 49.15 Favored Glycine 0 N--CA 1.442 -0.914 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.683 -179.719 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.489 ' O ' ' CB ' ' A' ' 409' ' ' TYR . 0.7 OUTLIER -134.21 143.69 48.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.603 -0.299 . . . . 0.0 111.755 -179.787 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.502 ' HA ' ' CD2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.1 -25.62 32.55 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.083 179.151 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 1.4 m -105.33 14.51 28.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.223 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.75 151.84 24.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.763 179.831 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.739 ' HA ' ' NE1' ' A' ' 410' ' ' TRP . 0.0 OUTLIER -61.1 -30.26 70.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 -179.827 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 412' ' ' LEU . . . -64.4 -29.28 70.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 179.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.502 ' CD2' ' HA ' ' A' ' 404' ' ' LYS . 3.5 t80 -71.17 -45.67 62.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.369 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.739 ' NE1' ' HA ' ' A' ' 407' ' ' LYS . 2.1 p-90 -73.07 -29.62 63.09 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.849 177.908 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 30.8 tp -69.65 -40.75 76.31 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.768 177.994 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.924 HD13 ' CE1' ' A' ' 400' ' ' PHE . 1.6 tp -61.97 -46.97 86.93 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.078 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.37 -32.2 69.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.758 177.961 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.58 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 1.3 mm-40 -63.61 -38.66 91.95 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.91 -179.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.454 ' CE ' HD22 ' A' ' 393' ' ' LEU . 42.9 ttp -69.6 -41.59 75.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.994 0.426 . . . . 0.0 110.28 179.332 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.43 HD11 HG22 ' A' ' 445' ' ' ILE . 10.3 tp -62.29 -45.1 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.684 179.661 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.44 HG22 HD13 ' A' ' 421' ' ' LEU . 2.0 m -62.73 -32.59 73.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.712 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -61.46 -42.82 99.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.537 179.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -67.49 -46.4 73.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.282 179.614 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.938 HD21 HG22 ' A' ' 442' ' ' VAL . 2.7 tm? -59.87 -38.53 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.441 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.44 HD13 HG22 ' A' ' 417' ' ' THR . 1.9 mp -64.88 -31.8 73.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.56 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.07 -46.27 88.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.798 ' HG ' HG11 ' A' ' 386' ' ' VAL . 37.3 mt -65.34 -33.99 77.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.869 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -5.18 54.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.3 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 32.2 t -89.37 10.64 21.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.609 0.242 . . . . 0.0 111.374 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 30.0 t -93.54 115.6 32.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.855 0.36 . . . . 0.0 110.912 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -82.14 87.69 6.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.905 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 9.9 t -73.79 149.81 41.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.845 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -127.66 41.31 1.61 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.518 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 128.11 -27.47 4.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.528 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.652 ' CG ' HG23 ' A' ' 434' ' ' VAL . 47.7 tp60 -58.53 92.48 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 0.0 111.043 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -66.44 -29.71 69.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 1.1 m -57.74 -44.15 85.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.984 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.652 HG23 ' CG ' ' A' ' 431' ' ' GLN . 29.5 t -64.86 -36.88 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.061 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -62.18 -40.91 97.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.858 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -36.13 77.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.798 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -70.87 -45.19 64.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.105 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 442' ' ' VAL . 4.4 ptt180 -69.22 -35.06 75.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -65.46 -39.58 92.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.513 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.27 -38.0 89.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.566 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.0 -42.23 98.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.801 179.812 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.938 HG22 HD21 ' A' ' 420' ' ' LEU . 11.8 t -62.97 -32.51 56.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.833 179.83 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 1.8 t -70.67 -40.59 72.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.777 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -72.97 -44.59 60.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.856 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.704 HD12 ' N ' ' A' ' 446' ' ' GLN . 2.8 pp -64.66 -31.09 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.076 0.465 . . . . 0.0 110.624 179.575 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.704 ' N ' HD12 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -66.15 -44.03 85.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.449 179.7 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -60.3 -37.35 80.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.948 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.501 HG22 HG11 ' A' ' 397' ' ' VAL . 29.7 mt -70.99 -36.51 63.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.863 179.737 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -53.22 60.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.942 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.99 -41.07 91.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.466 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.79 -30.6 65.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.59 ' CD1' HD23 ' A' ' 412' ' ' LEU . 4.1 tp -70.37 -36.48 74.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.334 179.124 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -29.73 61.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.598 179.565 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.5 -12.19 30.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.475 179.871 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -25.55 33.53 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.896 0.379 . . . . 0.0 110.484 179.708 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -80.39 -73.7 1.15 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.395 179.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.416 ' N ' ' HB2' ' A' ' 404' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.852 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.166 0 N-CA-C 112.525 -0.23 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 61.19 77.19 0.37 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.797 0.332 . . . . 0.0 110.921 179.955 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -68.15 -12.6 35.6 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.507 2.138 . . . . 0.0 112.461 179.831 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 68.7 -68.72 0.17 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.096 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -147.59 142.04 26.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.846 0.355 . . . . 0.0 110.964 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.407 HG22 ' HE2' ' A' ' 381' ' ' LYS . 0.2 OUTLIER 53.27 64.25 7.23 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.967 -179.969 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.533 ' HG2' HG13 ' A' ' 380' ' ' ILE . 52.7 Cg_exo -55.95 172.54 0.55 Allowed 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.614 2.21 . . . . 0.0 112.158 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . 0.439 ' HD2' ' HB3' ' A' ' 377' ' ' PRO . 23.0 Cg_endo -63.98 -78.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.533 2.155 . . . . 0.0 113.896 -178.819 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -22.36 66.4 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.34 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.712 HG22 HD11 ' A' ' 384' ' ' ILE . 31.8 mm -58.75 -29.93 41.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.773 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.45 ' HA ' HG12 ' A' ' 384' ' ' ILE . 7.5 mmtt -56.92 -33.27 66.78 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.583 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.34 -37.93 81.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.19 0.519 . . . . 0.0 110.473 179.473 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.481 HG21 ' HB1' ' A' ' 437' ' ' ALA . 19.4 mm -60.31 -33.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.441 178.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.712 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.88 -44.68 44.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.471 178.493 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -58.42 -49.36 77.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.686 179.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.887 HG11 ' HB3' ' A' ' 423' ' ' LEU . 77.6 t -65.94 -43.95 92.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.753 179.673 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.44 -35.8 78.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.898 0.38 . . . . 0.0 110.505 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 391' ' ' GLN . 4.5 mt-10 -62.79 -34.92 78.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.232 0.539 . . . . 0.0 109.637 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.25 -34.52 72.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.569 179.669 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 386' ' ' VAL . 36.8 t -62.42 -46.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.455 -179.714 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 388' ' ' GLU . 2.8 pt20 -64.32 -36.34 83.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.862 0.363 . . . . 0.0 110.666 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -34.99 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.188 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.897 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.3 OUTLIER -68.0 -37.91 82.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.261 179.429 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -39.1 79.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.615 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -39.2 80.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.458 179.659 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.4 -44.58 71.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.223 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 393' ' ' LEU . 21.8 t -60.82 -47.49 93.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.414 -179.584 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.66 -29.91 64.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.696 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -87.57 -57.63 2.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.975 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.575 ' CE1' ' HG ' ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.76 128.75 36.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.905 -179.853 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 402' ' ' GLY . 29.4 m -124.37 40.55 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.414 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.526 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -52.97 -163.44 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.002 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 406' ' ' ASP . 0.0 OUTLIER -133.24 143.67 49.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.01 0.433 . . . . 0.0 111.44 -179.354 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.461 ' HA ' ' CE1' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -55.23 -24.48 27.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.861 -179.888 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.69 14.03 24.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.352 -179.797 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.546 ' HB2' ' HG2' ' A' ' 403' ' ' LYS . 2.9 t0 -95.62 154.07 17.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.37 . . . . 0.0 111.171 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -71.36 -43.48 66.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.704 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.94 -33.1 74.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.535 179.682 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.53 ' CB ' ' O ' ' A' ' 403' ' ' LYS . 4.0 t80 -67.59 -44.24 78.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.287 179.634 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.432 ' O ' ' HB2' ' A' ' 414' ' ' GLU . 0.0 OUTLIER -56.01 -48.44 75.9 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.43 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 4.0 mm? -60.11 -37.96 81.58 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.111 176.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.575 ' HG ' ' CE1' ' A' ' 400' ' ' PHE . 0.1 OUTLIER -59.4 -47.73 84.33 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.483 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -71.02 -32.64 69.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.53 177.432 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.0 OUTLIER -64.16 -46.5 83.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 114.992 -1.003 . . . . 0.0 111.644 -179.312 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.533 ' HE2' HD13 ' A' ' 412' ' ' LEU . 5.5 ptt? -64.56 -39.68 94.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.744 0.306 . . . . 0.0 110.856 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.719 HD23 HD22 ' A' ' 393' ' ' LEU . 3.4 tm? -60.69 -38.41 84.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.926 0.393 . . . . 0.0 110.708 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.527 ' O ' HD13 ' A' ' 421' ' ' LEU . 1.3 m -67.54 -38.53 84.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.114 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.09 -40.92 82.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.004 -179.853 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.447 ' HG3' HD11 ' A' ' 393' ' ' LEU . 0.9 OUTLIER -63.5 -46.34 86.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.013 0.435 . . . . 0.0 110.136 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.811 ' CD2' HG22 ' A' ' 442' ' ' VAL . 2.7 tm? -62.14 -37.34 84.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.442 179.422 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 417' ' ' THR . 7.3 mp -70.5 -31.8 69.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -46.39 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.141 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.887 ' HB3' HG11 ' A' ' 386' ' ' VAL . 4.2 pp -67.91 -30.76 70.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.12 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . 0.807 ' N ' HD12 ' A' ' 423' ' ' LEU . 4.1 t70 -83.92 11.33 7.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.595 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 26.9 t -100.27 -19.02 16.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.682 0.277 . . . . 0.0 111.359 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 423' ' ' LEU . 29.8 m -66.61 137.84 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.903 0.382 . . . . 0.0 111.167 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.86 149.04 29.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.931 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -148.06 118.08 7.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.927 -179.885 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -78.52 -50.89 5.86 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.985 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -172.22 35.97 0.15 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.421 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . 0.438 ' CD ' HG23 ' A' ' 434' ' ' VAL . 0.7 OUTLIER -97.28 102.59 14.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.875 0.369 . . . . 0.0 110.895 -179.968 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -60.14 -30.53 69.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.886 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -44.86 92.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.857 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.438 HG23 ' CD ' ' A' ' 431' ' ' GLN . 23.4 t -75.11 -42.48 44.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.985 179.93 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -63.08 -39.68 95.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.821 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . 0.412 ' HA ' ' HG2' ' A' ' 439' ' ' LYS . 2.5 tt0 -68.08 -37.58 81.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.481 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.08 -34.53 66.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.224 -179.867 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.442 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.1 OUTLIER -69.83 -44.53 69.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.799 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 436' ' ' GLN . 0.0 OUTLIER -64.65 -31.5 72.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 110.509 179.661 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 439' ' ' LYS . 8.7 tp10 -65.89 -40.06 91.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.52 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.58 92.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.631 179.7 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.811 HG22 ' CD2' ' A' ' 420' ' ' LEU . 12.3 t -62.95 -30.88 50.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.772 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -45.67 65.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.944 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -44.14 96.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.533 HG12 ' HA ' ' A' ' 442' ' ' VAL . 34.3 pt -64.8 -31.22 52.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.043 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.435 ' N ' HG13 ' A' ' 445' ' ' ILE . 0.0 OUTLIER -62.8 -40.95 98.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.223 179.733 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.5 ' HB1' ' HZ1' ' A' ' 451' ' ' LYS . . . -66.51 -35.63 80.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.36 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.86 ' CG2' HG21 ' A' ' 397' ' ' VAL . 19.3 mt -74.8 -36.67 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.665 179.489 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.61 -47.54 81.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.626 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.2 -40.95 90.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.302 179.477 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . 0.5 ' HZ1' ' HB1' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -57.79 -30.11 65.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.086 0.47 . . . . 0.0 109.894 178.956 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.793 ' HG ' HG13 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -76.25 -36.73 58.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.416 179.392 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -41.53 93.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -78.96 -20.99 47.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.186 -179.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.411 ' HE3' HG12 ' A' ' 397' ' ' VAL . 0.2 OUTLIER -82.42 -19.97 37.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -77.33 -88.44 0.35 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.478 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 371' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.203 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 77.7 p -169.63 81.51 0.64 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.72 0.295 . . . . 0.0 110.859 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.89 154.56 67.11 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.503 2.135 . . . . 0.0 112.247 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -59.62 163.23 4.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 375' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -91.59 50.01 1.66 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . 0.763 HG22 ' HD2' ' A' ' 377' ' ' PRO . 0.2 OUTLIER -76.51 146.88 77.9 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 179.981 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.763 ' HD2' HG22 ' A' ' 376' ' ' THR . 42.4 Cg_endo -65.14 178.7 1.81 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.768 2.312 . . . . 0.0 112.492 179.889 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 378' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -92.92 -60.19 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.099 2.533 . . . . 0.0 113.191 -179.657 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 379' ' ' SER . . . . . . . . . . . . . 15.5 t -86.75 -32.71 20.26 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 120.653 0.263 . . . . 0.0 111.611 -179.215 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 380' ' ' ILE . . . . . 0.746 ' HB ' ' CG ' ' A' ' 377' ' ' PRO . 3.0 mp -58.66 -29.53 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 381' ' ' LYS . . . . . 0.508 ' NZ ' HG21 ' A' ' 376' ' ' THR . 0.0 OUTLIER -56.8 -33.4 66.63 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.796 179.838 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 382' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -68.32 -37.97 81.08 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.221 0.534 . . . . 0.0 110.505 179.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 383' ' ' ILE . . . . . 0.857 HD11 HG13 ' A' ' 434' ' ' VAL . 48.6 mt -60.45 -33.96 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.408 178.827 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 384' ' ' ILE . . . . . 0.709 HD11 HG22 ' A' ' 380' ' ' ILE . 0.3 OUTLIER -74.95 -44.67 44.51 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.194 178.424 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 385' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -59.49 -49.34 78.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.602 179.721 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 386' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 390' ' ' VAL . 13.7 p -63.83 -35.45 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.368 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 6.9 tt -67.44 -34.29 76.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.262 179.454 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 388' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 391' ' ' GLN . 0.3 OUTLIER -62.76 -35.15 78.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.601 179.017 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -35.43 73.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.569 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 386' ' ' VAL . 32.9 t -69.25 -46.82 76.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 391' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 388' ' ' GLU . 14.8 pt20 -58.36 -37.99 76.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.661 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -67.19 -42.86 83.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.435 179.556 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 393' ' ' LEU . . . . . 0.819 ' O ' HG23 ' A' ' 397' ' ' VAL . 0.4 OUTLIER -64.34 -37.92 89.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.332 179.368 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -39.16 81.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.542 179.653 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 395' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -63.12 -43.22 99.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.46 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 396' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.22 -42.07 76.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.492 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 397' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 393' ' ' LEU . 50.7 t -60.63 -32.17 50.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.398 179.472 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.7 -40.04 86.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.973 179.319 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.406 ' O ' ' O ' ' A' ' 400' ' ' PHE . 7.9 tt0 -86.51 -68.77 0.72 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.846 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.824 ' CD1' HD22 ' A' ' 412' ' ' LEU . 4.5 t80 57.13 144.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.16 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 401' ' ' VAL . . . . . 0.529 ' O ' HG12 ' A' ' 401' ' ' VAL . 11.9 t -125.98 21.62 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.916 178.701 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 402' ' ' GLY . . . . . 0.601 ' HA3' ' CZ ' ' A' ' 400' ' ' PHE . . . -110.93 179.37 20.02 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.472 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 403' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -134.34 151.43 51.23 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.363 -0.419 . . . . 0.0 111.713 -179.618 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 404' ' ' LYS . . . . . 0.555 ' HA ' ' CG ' ' A' ' 409' ' ' TYR . 0.0 OUTLIER -51.5 -31.91 25.58 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.128 179.233 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 8.9 t -97.2 15.67 22.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.196 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 406' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 403' ' ' LYS . 1.8 t70 -115.23 155.06 27.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.848 0.356 . . . . 0.0 110.959 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 407' ' ' LYS . . . . . 0.79 ' HA ' ' CE2' ' A' ' 410' ' ' TRP . 4.0 mtmp? -61.72 -30.04 70.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.891 179.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 408' ' ' ALA . . . . . . . . . . . . . . . -62.83 -29.24 70.58 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 409' ' ' TYR . . . . . 0.555 ' CG ' ' HA ' ' A' ' 404' ' ' LYS . 10.7 t80 -70.55 -45.81 64.77 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -178.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 410' ' ' TRP . . . . . 0.79 ' CE2' ' HA ' ' A' ' 407' ' ' LYS . 1.1 p-90 -72.94 -29.12 62.86 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 118.804 -1.158 . . . . 0.0 108.888 177.979 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 411' ' ' LEU . . . . . 0.592 ' HA ' ' HB2' ' A' ' 414' ' ' GLU . 33.3 tp -69.59 -38.66 77.43 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.258 178.091 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.824 HD22 ' CD1' ' A' ' 400' ' ' PHE . 11.6 tp -62.15 -47.17 85.75 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.796 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.49 -32.14 69.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.732 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 414' ' ' GLU . . . . . 0.592 ' HB2' ' HA ' ' A' ' 411' ' ' LEU . 0.2 OUTLIER -63.62 -46.59 85.04 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -178.982 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 415' ' ' MET . . . . . 0.583 ' HG3' HD12 ' A' ' 416' ' ' LEU . 2.5 ptt? -64.47 -38.72 92.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 110.272 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.643 HD13 ' O ' ' A' ' 412' ' ' LEU . 8.7 mp -68.88 -37.17 78.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.632 179.233 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.449 ' HA ' HD23 ' A' ' 420' ' ' LEU . 81.4 m -67.15 -35.67 80.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -179.257 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.463 ' HG2' ' HA ' ' A' ' 415' ' ' MET . 0.1 OUTLIER -72.16 -34.54 68.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.573 0.225 . . . . 0.0 111.594 -179.371 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 419' ' ' GLU . . . . . 0.753 ' OE1' HD22 ' A' ' 393' ' ' LEU . 9.0 pt-20 -72.2 -41.99 66.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.675 0.274 . . . . 0.0 111.043 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 420' ' ' LEU . . . . . 0.578 HD11 HD12 ' A' ' 421' ' ' LEU . 1.2 pp -67.49 -38.19 83.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.822 0.344 . . . . 0.0 110.755 179.941 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 421' ' ' LEU . . . . . 0.578 HD12 HD11 ' A' ' 420' ' ' LEU . 0.6 OUTLIER -68.32 -33.24 73.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.711 179.807 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -40.3 95.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.778 179.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -31.9 65.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.801 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -31.47 72.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.804 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 40.4 t -59.63 -26.47 65.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 426' ' ' VAL . . . . . . . . . . . . . 40.6 t -66.63 126.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.23 176.43 7.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 428' ' ' THR . . . . . . . . . . . . . 3.9 t -162.59 160.28 25.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.864 179.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -146.87 85.91 0.17 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 65.49 28.26 73.4 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.481 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 431' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -106.81 94.47 5.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.804 0.335 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.99 -33.65 72.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 433' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -39.62 94.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.881 179.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 434' ' ' VAL . . . . . 0.857 HG13 HD11 ' A' ' 383' ' ' ILE . 24.5 t -76.04 -46.17 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.104 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 435' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.04 -40.32 95.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.842 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -69.32 -35.18 75.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.935 179.907 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.52 ' HB1' HG21 ' A' ' 383' ' ' ILE . . . -73.2 -45.18 57.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.456 -179.738 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 438' ' ' ARG . . . . . 0.415 ' O ' HG23 ' A' ' 442' ' ' VAL . 0.2 OUTLIER -67.55 -40.02 84.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.884 -179.87 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.46 -44.87 85.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.026 0.441 . . . . 0.0 110.355 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -61.52 -31.6 71.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.285 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.28 -38.8 91.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.876 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 442' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 438' ' ' ARG . 26.8 t -62.64 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 443' ' ' CYS . . . . . 0.645 ' HA ' ' HG3' ' A' ' 446' ' ' GLN . 1.3 m -60.7 -30.01 69.68 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . 0.409 ' O ' HG13 ' A' ' 448' ' ' ILE . 0.0 OUTLIER -63.55 -41.6 98.43 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.769 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 445' ' ' ILE . . . . . 0.602 HD13 ' N ' ' A' ' 445' ' ' ILE . 0.6 OUTLIER -73.67 -35.26 43.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.508 0.671 . . . . 0.0 109.821 178.669 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . 0.645 ' HG3' ' HA ' ' A' ' 443' ' ' CYS . 0.4 OUTLIER -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.285 179.438 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.47 -40.45 86.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.121 179.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 448' ' ' ILE . . . . . 0.568 HG22 HG11 ' A' ' 397' ' ' VAL . 10.1 mt -72.75 -36.15 51.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.21 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -41.54 78.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.027 -179.198 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.5 -42.77 67.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -29.97 65.62 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.612 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.511 ' CG ' HD23 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -71.32 -36.64 71.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.677 179.349 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.16 -29.86 61.4 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.41 -8.92 26.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.824 -179.809 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 452' ' ' LEU . 0.3 OUTLIER -82.52 -26.0 32.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 110.872 179.866 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -83.65 -73.57 1.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.276 -179.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.865 -179.951 . . . . . . . . 1 1 . 1 stop_ save_