data_2jwh_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 2jwh _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 446' ' ' CYS . . . . . 0.411 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 57.0 m . . . . . 0 N--CA 1.451 -0.417 0 CA-C-O 121.428 0.633 . . . . 0.0 109.786 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 14.3 tptm -60.73 118.15 6.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.598 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.52 -25.87 8.88 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.146 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.575 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 68.4 mttm -69.33 144.02 53.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.61 0.243 . . . . 0.0 111.565 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -77.79 176.12 53.98 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 171.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -56.31 -44.34 79.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.858 0.329 . . . . 0.0 111.24 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -64.91 -40.63 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.575 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 47.2 m-20 -69.33 -43.62 73.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.711 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 8.7 t -60.93 111.32 1.62 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.733 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 95.0 mttt -82.95 127.03 33.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.547 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 69.8 m -61.39 -49.0 89.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.547 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -58.37 -28.3 84.45 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 121.796 1.664 . . . . 0.0 111.96 177.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.638 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 0.7 OUTLIER -86.87 -45.67 10.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.991 -178.219 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.1 m -140.77 146.63 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.73 -172.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.477 ' HG3' ' HG3' ' A' ' 462' ' ' GLU . 24.7 tptp -88.7 112.9 23.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.478 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -83.87 106.92 15.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.477 ' HG3' ' HG3' ' A' ' 460' ' ' LYS . 51.4 mt-10 -138.42 132.33 31.22 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.154 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.19 41.39 99.47 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.685 -0.688 . . . . 0.0 112.836 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.06 36.29 92.09 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.319 -0.467 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 89.1 m -149.97 129.23 12.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.787 0.327 . . . . 0.0 110.511 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 22.8 t -87.53 126.51 34.96 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.473 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 52.1 pttt -151.4 142.57 23.22 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.569 0.699 . . . . 0.0 112.146 -174.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 C--O 1.247 0.972 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.446 175.791 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.68 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 42.5 m . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 121.31 0.576 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -53.0 128.46 27.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.266 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 100.33 -22.76 38.59 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.023 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -71.04 137.46 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.959 0.409 . . . . 0.0 112.097 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.22 176.75 49.5 Favored Glycine 0 N--CA 1.444 -0.788 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 171.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -63.89 -43.4 96.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 117.193 0.497 . . . . 0.0 110.413 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . 0.507 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 10.2 mptt -82.45 37.5 0.51 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.368 0.604 . . . . 0.0 111.016 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.73 -41.66 0.1 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.6 t -54.68 108.52 0.4 Allowed 'General case' 0 C--O 1.237 0.406 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.463 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 458' ' ' ASP . 0.3 OUTLIER -71.11 126.97 31.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.108 178.44 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.518 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.6 m -67.55 -46.99 47.44 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.838 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 456' ' ' SER . 24.8 Cg_endo -61.83 -36.21 74.44 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.187 1.258 . . . . 0.0 111.772 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.457 ' HB2' ' HB3' ' A' ' 455' ' ' LYS . 9.3 m-20 -79.47 -39.82 31.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.177 -178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 10.3 m -133.35 -148.63 0.34 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.962 -171.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.51 ' HG3' ' HB2' ' A' ' 467' ' ' LYS . 9.9 ptpp? -167.51 149.13 5.63 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -97.94 133.19 42.76 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.506 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -139.86 122.69 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.41 -92.66 0.13 Allowed Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 -176.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -147.62 36.07 1.18 Allowed Glycine 0 N--CA 1.439 -1.147 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 1.9 p -140.62 144.15 35.59 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.293 0.568 . . . . 0.0 112.332 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.68 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 19.6 t -81.7 109.48 16.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.72 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.637 ' HA ' ' HE2' ' A' ' 467' ' ' LYS . 10.5 mmpt? -85.96 139.16 31.44 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.559 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.251 176.741 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.454 -0.27 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.3 tttm -61.43 105.24 0.49 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.592 173.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 136.74 -32.88 2.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.897 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 9.9 mmmm -65.76 142.45 57.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.273 . . . . 0.0 110.292 177.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.73 -176.85 22.46 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.141 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.53 -45.21 94.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.899 0.349 . . . . 0.0 111.19 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -71.29 -42.08 69.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 110.557 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.897 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.8 OUTLIER -65.03 -31.42 72.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.369 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.415 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 9.7 t -70.42 89.18 0.68 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.21 0.528 . . . . 0.0 109.736 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -83.97 147.4 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.189 -176.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.48 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 15.4 m -60.77 -48.57 92.64 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.48 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 17.4 Cg_exo -64.66 -27.2 60.8 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.583 1.522 . . . . 0.0 111.487 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -82.47 -40.97 20.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.515 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.471 ' SG ' ' N ' ' A' ' 460' ' ' LYS . 22.1 t -162.99 -151.54 0.19 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.263 0.554 . . . . 0.0 111.103 -171.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.471 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 42.4 mmtm -147.2 127.67 14.07 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.577 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.415 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 67.0 t-105 -88.69 118.44 28.37 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -75.62 -72.21 0.33 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -178.2 41.09 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 155.32 -33.03 0.65 Allowed Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -176.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 28.0 m -132.46 136.89 47.01 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 120.874 0.369 . . . . 0.0 110.545 -179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 8.2 t -75.28 144.24 42.6 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -177.27 126.97 0.15 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.387 0.613 . . . . 0.0 111.229 -176.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.572 -178.321 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.435 ' HB3' ' SG ' ' A' ' 454' ' ' CYS . 17.4 m . . . . . 0 N--CA 1.453 -0.321 0 CA-C-O 120.212 0.053 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -58.6 117.36 4.45 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 121.03 -28.99 5.91 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.969 -175.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -73.1 146.5 45.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.683 0.277 . . . . 0.0 111.339 -179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -81.76 173.72 53.81 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.59 173.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -63.6 -33.16 75.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' A' ' 452' ' ' LYS . 13.4 ptmm? -83.12 35.47 0.49 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.257 0.551 . . . . 0.0 111.269 177.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -160.08 -50.92 0.05 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.631 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.435 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.5 OUTLIER -72.46 120.6 18.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.027 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.475 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 16.4 ptpt -75.39 122.03 23.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.314 178.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' SER . . . . . . . . . . . . . 21.1 m -69.57 -44.78 25.42 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -173.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.22 -40.61 81.38 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.179 1.253 . . . . 0.0 111.531 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.475 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 27.5 t70 -80.68 -43.46 20.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.753 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 88.3 m -121.6 133.88 55.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.164 0.507 . . . . 0.0 111.233 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.658 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 46.4 mttt -64.73 138.57 58.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.096 -176.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.449 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 61.3 t-105 -119.31 129.44 54.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.317 175.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -170.15 131.97 1.03 Allowed 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.214 0.321 . . . . 0.0 110.717 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 63.34 36.82 93.91 Favored Glycine 0 CA--C 1.517 0.192 0 CA-C-N 116.173 -0.467 . . . . 0.0 113.256 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.14 39.76 97.59 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.768 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.4 t -161.77 139.92 9.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.449 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 1.6 t -91.79 144.12 25.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.185 -176.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.658 ' HG2' ' HB2' ' A' ' 460' ' ' LYS . 0.0 OUTLIER -149.42 146.86 27.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.647 0.26 . . . . 0.0 110.811 -178.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 50.1 t0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.688 -0.672 . . . . 0.0 109.593 179.501 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.709 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 90.1 m . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -52.78 115.35 1.78 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.787 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 122.4 -28.48 5.76 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.587 -176.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.67 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 22.5 mtmm -80.41 138.26 36.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.578 0.227 . . . . 0.0 111.474 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -76.64 -169.79 30.69 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -62.67 -46.04 90.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.95 0.375 . . . . 0.0 111.539 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -64.3 -34.19 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 111.045 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.2 -40.32 27.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.876 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 14.7 t -58.65 114.09 2.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.958 -177.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.837 ' HA ' ' HE3' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -87.51 125.39 34.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.019 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.531 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 m -60.8 -49.03 91.24 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.6 Cg_endo -60.11 -26.74 83.3 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.022 1.815 . . . . 0.0 112.078 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -87.85 -45.34 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.924 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 68.9 m -146.27 152.65 39.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.271 0.558 . . . . 0.0 111.63 -176.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.1 131.84 35.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.3 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -78.71 113.55 16.87 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -74.58 -47.26 33.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.006 0.431 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.71 -46.47 0.18 Allowed Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.226 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -140.07 31.53 2.26 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 177.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.7 t -170.94 145.31 2.32 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.026 0.441 . . . . 0.0 110.242 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.709 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 12.3 t -87.7 132.23 34.19 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.43 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 0.0 OUTLIER -158.29 153.19 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.838 -171.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.887 179.455 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.496 ' SG ' ' HE2' ' A' ' 449' ' ' LYS . 3.6 t . . . . . 0 CA--C 1.534 0.338 0 CA-C-O 120.91 0.386 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.428 ' HE2' ' OG1' ' A' ' 465' ' ' THR . 55.0 tttm -59.37 128.82 39.01 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.361 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.05 -34.6 2.51 Favored Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -176.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.593 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 49.2 mtmt -76.63 139.86 40.76 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 177.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -66.95 174.51 25.44 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.85 -0.691 . . . . 0.0 111.45 176.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -58.01 -37.29 74.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.21 -43.48 74.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.383 . . . . 0.0 110.684 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.593 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 3.6 m-20 -72.07 -39.97 68.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.718 -179.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -73.97 71.22 1.55 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.92 176.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.745 ' HG3' ' HD2' ' A' ' 457' ' ' PRO . 20.7 tptm -64.29 135.06 55.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.53 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.543 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 37.2 m -53.72 -51.94 71.95 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -173.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.745 ' HD2' ' HG3' ' A' ' 455' ' ' LYS . 36.2 Cg_exo -61.18 -32.85 91.22 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 121.582 1.521 . . . . 0.0 111.553 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -77.58 -44.7 27.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.727 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 96.9 m -149.71 147.47 28.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 0.0 110.843 -175.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.693 ' HB2' ' HG3' ' A' ' 467' ' ' LYS . 49.4 mmtm -79.19 129.86 34.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.452 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -107.79 125.84 51.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.52 ' HB2' ' NZ ' ' A' ' 467' ' ' LYS . 12.7 tp10 -86.75 -131.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . 0.423 ' H ' ' HG3' ' A' ' 462' ' ' GLU . . . -82.3 -41.11 9.48 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.443 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -159.08 45.4 0.45 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.428 ' OG1' ' HE2' ' A' ' 447' ' ' LYS . 9.6 t -163.4 136.73 5.63 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.547 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 447' ' ' LYS . 11.2 t -90.01 145.86 24.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.959 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.693 ' HG3' ' HB2' ' A' ' 460' ' ' LYS . 9.4 ptpp? -144.88 160.48 41.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.666 0.269 . . . . 0.0 110.391 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.736 -0.65 . . . . 0.0 110.821 -176.977 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.633 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.0 m . . . . . 0 CA--C 1.533 0.291 0 CA-C-O 120.73 0.3 . . . . 0.0 111.332 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -53.52 133.01 41.1 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 68.01 33.76 80.01 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.115 -0.948 . . . . 0.0 114.529 171.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.633 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 46.8 mtmt -119.44 147.47 44.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.444 0.622 . . . . 0.0 110.626 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.36 155.48 53.05 Favored Glycine 0 C--O 1.225 -0.409 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.8 -33.99 67.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.297 0.548 . . . . 0.0 111.361 -177.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -57.02 -40.91 77.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.968 0.414 . . . . 0.0 110.535 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.553 ' OD2' ' HD2' ' A' ' 449' ' ' LYS . 33.5 t70 -91.57 -49.18 6.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.061 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.8 OUTLIER -73.21 92.88 1.79 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 111.832 -177.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -152.7 135.04 15.06 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.612 ' C ' ' H ' ' A' ' 458' ' ' ASP . 2.8 t -167.36 149.99 5.69 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.617 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -73.74 26.07 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.395 2.064 . . . . 0.0 109.798 172.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.612 ' H ' ' C ' ' A' ' 456' ' ' SER . 35.2 t70 -151.5 -43.23 0.11 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.569 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.443 ' HB2' ' HB3' ' A' ' 456' ' ' SER . 73.8 m -71.75 138.87 48.77 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.393 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.405 ' HB3' ' NZ ' ' A' ' 460' ' ' LYS . 6.2 ttpm? -113.3 137.42 51.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.861 0.362 . . . . 0.0 110.719 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.756 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 58.7 t-105 -95.84 122.33 38.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.745 177.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.587 ' HG3' ' HE3' ' A' ' 467' ' ' LYS . 48.0 mm-40 -82.4 -38.43 24.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.186 0.517 . . . . 0.0 110.822 -178.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 155.49 -50.31 0.46 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -134.57 29.85 2.95 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 174.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.3 t -175.0 145.18 0.8 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.109 -0.545 . . . . 0.0 109.727 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.756 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 15.8 t -112.76 132.6 55.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.375 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.587 ' HE3' ' HG3' ' A' ' 462' ' ' GLU . 22.4 pttp -178.12 142.67 0.28 Allowed 'General case' 0 C--O 1.233 0.209 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 40.2 t0 . . . . . 0 C--O 1.253 1.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.914 175.94 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.582 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 85.2 m . . . . . 0 CA--C 1.514 -0.439 0 CA-C-O 121.754 0.788 . . . . 0.0 111.324 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.489 ' NZ ' ' HB2' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -78.73 134.73 37.04 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.808 -177.225 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.7 32.82 35.98 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.509 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -113.51 143.12 45.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.45 163.76 52.91 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.604 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.63 -40.38 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.151 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 12.5 mptt -74.39 -34.6 63.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -71.61 -45.48 61.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 0.0 110.03 177.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.467 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.1 t -60.45 133.08 55.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.179 176.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -128.7 134.4 48.47 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.564 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 8.7 m -54.37 -50.74 83.3 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -173.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.564 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 31.9 Cg_exo -59.02 -28.22 87.25 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.824 1.683 . . . . 0.0 111.267 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -81.22 -54.58 5.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.548 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 95.1 m -155.8 158.88 38.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.101 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -89.37 137.67 32.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.939 0.4 . . . . 0.0 111.459 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.467 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 66.3 t-105 -89.25 117.99 28.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.66 174.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.497 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 6.0 mm-40 -119.05 116.62 26.78 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.958 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 66.15 -66.75 0.14 Allowed Glycine 0 C--N 1.333 0.385 0 O-C-N 123.807 0.692 . . . . 0.0 113.476 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -170.36 38.58 0.19 Allowed Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.5 t -159.8 139.98 11.79 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -178.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.582 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.7 t -94.82 139.03 31.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -174.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.497 ' HD3' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -155.55 151.87 28.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.34 . . . . 0.0 111.147 -177.568 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.781 -179.493 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.58 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 24.9 p . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.677 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 60.2 tttm -43.75 120.0 1.87 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.826 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.99 -32.83 5.31 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -61.58 152.81 29.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.009 0.433 . . . . 0.0 111.809 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.48 166.52 54.61 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.045 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -55.3 -50.76 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 26.5 tttm -63.85 -43.0 97.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.835 0.35 . . . . 0.0 110.801 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -67.19 -42.91 83.41 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.709 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.429 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 12.1 t -60.45 105.68 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.2 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 454' ' ' CYS . 38.7 mmtm -165.38 43.58 0.08 Allowed 'General case' 0 CA--C 1.498 -1.032 0 CA-C-O 121.854 0.835 . . . . 0.0 108.928 176.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.71 ' HB2' ' CB ' ' A' ' 459' ' ' CYS . 50.3 m -72.19 135.12 82.41 Favored Pre-proline 0 C--N 1.296 -1.737 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.935 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.75 24.44 0.29 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.559 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.703 ' H ' ' C ' ' A' ' 456' ' ' SER . 46.0 t0 -148.69 -27.86 0.3 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 112.818 -1.992 . . . . 0.0 108.84 -176.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.71 ' CB ' ' HB2' ' A' ' 456' ' ' SER . 13.7 t -88.49 -174.77 4.72 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.039 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.427 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 5.4 mmmm -158.41 135.02 9.55 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.356 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.429 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 56.3 t-105 -85.79 122.21 29.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.449 ' O ' HG21 ' A' ' 465' ' ' THR . 71.4 tt0 -156.68 130.01 8.05 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.894 -178.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.99 36.76 92.45 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.298 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.62 82.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.604 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.449 HG21 ' O ' ' A' ' 462' ' ' GLU . 15.0 t -157.9 142.45 16.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.357 0.598 . . . . 0.0 110.945 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.677 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 5.5 t -79.32 142.1 36.4 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.1 pttp 178.07 137.87 0.08 Allowed 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.048 0.451 . . . . 0.0 111.217 -177.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 54.1 t0 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.506 -0.759 . . . . 0.0 109.446 174.926 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 79.3 m . . . . . 0 N--CA 1.453 -0.299 0 CA-C-O 120.935 0.397 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -58.9 126.46 27.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.427 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 120.44 -31.44 5.24 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.597 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -70.09 139.48 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.751 0.31 . . . . 0.0 111.329 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.37 165.34 54.32 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.42 -48.36 71.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.179 0.489 . . . . 0.0 111.692 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -67.56 -34.47 77.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.033 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -74.0 -44.32 54.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.853 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.0 t -54.99 119.26 5.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.124 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -90.38 123.64 34.28 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.491 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 28.2 t -57.19 -49.3 94.7 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 39.7 Cg_exo -60.57 -29.94 89.58 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 121.854 1.702 . . . . 0.0 111.786 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -82.32 -49.12 10.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.116 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.433 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 20.2 m -140.81 135.95 31.94 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -80.08 122.57 26.94 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.979 0.418 . . . . 0.0 110.484 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.461 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 68.6 t-105 -84.3 126.37 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.437 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 8.9 tt0 -156.97 133.3 9.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.604 0.24 . . . . 0.0 110.734 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.25 34.53 89.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.514 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.18 37.68 95.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.818 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 13.3 t -155.87 141.81 18.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.429 . . . . 0.0 110.314 177.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.461 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 30.9 t -89.05 126.52 35.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.812 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.437 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 63.5 pttt -144.25 139.85 28.9 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.805 0.336 . . . . 0.0 110.473 -178.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . 0.417 ' HB3' ' SG ' ' A' ' 446' ' ' CYS . 3.3 p30 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.636 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 58.1 m . . . . . 0 N--CA 1.442 -0.865 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -78.01 106.81 10.13 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.302 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 59.07 47.39 91.03 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.326 -0.852 . . . . 0.0 114.067 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.803 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 26.9 mtmt -107.55 -169.38 1.52 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.296 0.548 . . . . 0.0 110.25 174.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.44 154.1 36.08 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.29 -35.58 75.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.925 0.363 . . . . 0.0 110.453 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -57.77 -48.37 79.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.412 177.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.611 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.4 OUTLIER -68.92 -54.58 14.66 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.093 176.529 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.803 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 27.6 m -70.98 96.15 1.26 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.014 -0.994 . . . . 0.0 112.826 -174.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -145.9 142.51 28.83 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.561 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.593 ' C ' ' H ' ' A' ' 458' ' ' ASP . 3.3 t 174.71 149.26 0.25 Allowed Pre-proline 0 C--N 1.317 -0.814 0 O-C-N 124.138 0.899 . . . . 0.0 109.113 -178.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.76 27.88 0.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.268 1.979 . . . . 0.0 109.945 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.593 ' H ' ' C ' ' A' ' 456' ' ' SER . 11.6 t70 -150.58 -43.36 0.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.961 -177.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.484 ' SG ' ' HB3' ' A' ' 456' ' ' SER . 62.1 m -68.56 134.32 49.84 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 174.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -125.34 149.76 47.81 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.848 -175.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.512 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 29.7 t-105 -101.49 131.03 47.84 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.667 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.574 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 40.0 tp10 -158.73 122.08 3.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.821 0.343 . . . . 0.0 110.905 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.37 41.55 98.07 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.52 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.1 41.85 99.67 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.12 -0.562 . . . . 0.0 112.764 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -169.97 147.86 3.36 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.06 0.457 . . . . 0.0 110.451 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.512 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.6 OUTLIER -95.27 145.42 25.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.255 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.574 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 62.3 pttt -157.25 149.05 22.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.049 0.452 . . . . 0.0 111.933 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 59.9 t0 . . . . . 0 C--O 1.248 1.009 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.103 174.723 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.467 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 67.5 m . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 121.252 0.549 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -71.32 118.33 13.99 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.535 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.76 23.97 61.12 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.499 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.467 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 23.1 ttmm -90.41 138.4 31.57 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -71.19 164.62 53.7 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.741 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.13 -37.91 78.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 117.013 0.406 . . . . 0.0 111.783 -177.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -74.66 -39.61 61.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.825 0.345 . . . . 0.0 110.599 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -70.05 -40.69 74.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.797 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.529 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.0 t -61.53 125.97 25.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.624 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.415 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 7.8 ptpp? -124.79 132.28 53.36 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.333 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.508 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.5 m -52.83 -47.95 93.05 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -59.51 -25.93 80.35 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.718 1.612 . . . . 0.0 111.94 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.415 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 26.0 t70 -92.99 -46.56 7.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.52 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.487 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 85.4 m -147.23 156.34 42.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 110.83 -178.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -90.03 120.27 31.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.64 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.529 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 70.6 t-105 -81.69 117.56 22.12 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -84.03 -37.65 21.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.02 0.438 . . . . 0.0 110.499 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 166.74 -46.03 0.26 Allowed Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.342 -0.703 . . . . 0.0 111.342 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -131.67 -10.3 2.36 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 11.2 m -130.26 136.03 48.74 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.967 0.413 . . . . 0.0 110.7 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 18.2 t -92.46 119.86 32.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.437 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.27 133.21 49.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.052 -175.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 35.2 t70 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.576 -0.726 . . . . 0.0 110.869 178.423 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.437 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 76.7 m . . . . . 0 N--CA 1.452 -0.346 0 CA-C-O 120.798 0.333 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -48.38 122.34 5.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.924 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 61.35 33.51 84.82 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.411 -0.813 . . . . 0.0 113.907 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.76 ' HD3' ' HA ' ' A' ' 454' ' ' CYS . 18.2 ptmt -85.31 -19.94 30.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.174 0.487 . . . . 0.0 110.954 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 103.65 150.78 21.88 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.806 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . 0.416 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 29.1 tt0 -63.37 -43.1 98.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 122.455 0.302 . . . . 0.0 111.44 -175.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.52 42.04 0.81 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.365 0.603 . . . . 0.0 110.563 177.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -160.62 -38.14 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.445 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.76 ' HA ' ' HD3' ' A' ' 449' ' ' LYS . 19.9 t -74.49 73.98 1.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.09 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.5 132.83 47.65 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.467 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.3 m -50.19 -50.31 70.77 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -171.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 456' ' ' SER . 20.2 Cg_endo -61.6 -31.61 87.07 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.839 1.693 . . . . 0.0 111.688 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -83.29 -44.1 15.29 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.4 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.21 146.3 26.75 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -86.26 128.34 34.9 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.706 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.599 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 64.8 t-105 -96.13 111.15 23.27 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 174.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -82.88 47.11 1.16 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.978 0.418 . . . . 0.0 110.971 -176.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 57.95 38.13 87.78 Favored Glycine 0 C--N 1.33 0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.688 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 152.47 -37.48 0.79 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.179 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 24.4 m -123.16 129.16 51.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.201 . . . . 0.0 111.218 -177.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.599 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 23.2 t -82.01 138.06 34.97 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.33 141.43 32.36 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.01 0.433 . . . . 0.0 110.754 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.994 -178.467 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 2.9 m . . . . . 0 N--CA 1.449 -0.525 0 CA-C-O 120.731 0.3 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 81.1 tttt 33.07 75.67 0.05 OUTLIER 'General case' 0 C--O 1.235 0.294 0 N-CA-C 114.379 1.252 . . . . 0.0 114.379 176.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . 0.676 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . 48.66 35.1 15.93 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 114.562 -1.199 . . . . 0.0 115.37 169.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.689 ' HG3' ' HB2' ' A' ' 454' ' ' CYS . 0.3 OUTLIER -85.81 149.45 25.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.921 0.86 . . . . 0.0 108.84 173.111 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -56.04 150.97 22.61 Favored Glycine 0 C--O 1.227 -0.318 0 C-N-CA 121.444 -0.408 . . . . 0.0 113.384 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.6 -33.48 66.27 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.79 -176.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . 0.412 ' HA ' ' HD3' ' A' ' 452' ' ' LYS . 27.3 mmtp -61.66 -37.93 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.87 0.367 . . . . 0.0 110.204 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -81.06 -48.04 12.74 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.781 175.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.689 ' HB2' ' HG3' ' A' ' 449' ' ' LYS . 0.5 OUTLIER -84.58 116.71 23.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.519 -173.715 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -89.43 139.81 30.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.837 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.53 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 10.5 t -58.78 -48.79 96.17 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.994 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.3 Cg_endo -58.51 -29.85 89.99 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.853 1.702 . . . . 0.0 112.007 178.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -84.05 -42.32 16.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 67.7 m -141.58 149.82 41.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.372 -173.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -79.37 135.69 36.78 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.998 0.428 . . . . 0.0 110.532 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 52.3 t-105 -106.28 132.35 52.44 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.855 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.416 ' OE2' ' HD2' ' A' ' 467' ' ' LYS . 30.2 mt-10 -129.64 79.94 1.93 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.856 0.36 . . . . 0.0 111.402 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.29 -63.11 2.96 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.363 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.1 36.49 0.53 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.833 -0.698 . . . . 0.0 111.786 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.0 t -157.87 141.94 15.91 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.676 ' H ' ' HA2' ' A' ' 448' ' ' GLY . 0.5 OUTLIER -104.7 145.93 29.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.879 -178.22 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.416 ' HD2' ' OE2' ' A' ' 462' ' ' GLU . 18.5 ptpt -163.52 159.46 22.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.987 0.422 . . . . 0.0 111.764 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.2 t0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.967 176.427 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 83.5 m . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 120.735 0.303 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -64.74 117.73 7.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 139.25 -35.97 1.91 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -175.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.78 137.75 54.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.131 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.76 -169.99 41.94 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 169.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -67.11 -34.89 78.58 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 117.108 0.454 . . . . 0.0 111.234 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.67 -38.92 53.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.118 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.44 -49.07 67.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.511 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 4.7 t -62.4 123.46 18.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.347 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 51.5 mttm -141.91 33.28 1.58 Allowed 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 122.023 0.916 . . . . 0.0 110.114 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.672 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 39.0 m 45.67 50.12 7.41 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 113.059 -1.882 . . . . 0.0 113.136 178.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.556 ' HD3' ' N ' ' A' ' 456' ' ' SER . 5.2 Cg_exo -74.33 -44.75 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.902 1.735 . . . . 0.0 109.88 175.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.01 36.81 0.15 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 173.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.672 ' O ' ' HA ' ' A' ' 456' ' ' SER . 57.4 m -147.89 145.42 28.65 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.756 -171.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -114.41 136.47 52.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.747 0.308 . . . . 0.0 110.616 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 58.8 t-105 -80.94 118.63 22.59 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.769 ' HB3' ' HD2' ' A' ' 467' ' ' LYS . 34.2 tt0 -155.06 133.09 11.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.657 0.265 . . . . 0.0 110.724 -175.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.39 35.94 81.5 Favored Glycine 0 C--O 1.234 0.122 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.794 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 62.17 40.1 98.52 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.417 HG22 ' CG ' ' A' ' 467' ' ' LYS . 5.3 m -157.76 133.77 9.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.804 0.335 . . . . 0.0 110.529 -175.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . . . . . . . . . 11.9 t -86.62 119.41 26.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.769 ' HD2' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -157.85 155.12 29.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.752 -173.291 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.267 -0.873 . . . . 0.0 111.197 -176.493 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 65.1 m . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 120.592 0.234 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -62.64 120.83 11.94 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.277 -177.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 115.31 -17.43 16.67 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.292 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.62 ' HB3' ' HB3' ' A' ' 453' ' ' ASP . 42.6 mtmt -81.74 142.3 32.77 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.857 0.328 . . . . 0.0 110.825 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.61 167.15 50.74 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -56.95 -38.55 73.09 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -69.54 -31.09 69.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.774 0.321 . . . . 0.0 111.263 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.62 ' HB3' ' HB3' ' A' ' 449' ' ' LYS . 2.3 t0 -81.57 -38.67 25.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.0 109.519 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -60.61 145.73 47.89 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.559 174.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.479 ' HD2' ' O ' ' A' ' 453' ' ' ASP . 7.8 mptt -137.29 148.78 46.63 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.493 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 3.5 m -63.41 -47.51 83.73 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 456' ' ' SER . 37.7 Cg_endo -65.25 -29.38 55.2 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 121.029 1.152 . . . . 0.0 110.965 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.54 -48.36 22.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.41 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 36.4 m -158.06 -162.17 1.11 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.175 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -121.65 136.92 54.93 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.313 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.457 ' CE3' ' HB2' ' A' ' 466' ' ' CYS . 71.9 t-105 -103.18 124.75 49.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.6 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -135.5 110.88 9.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.761 0.315 . . . . 0.0 110.781 -178.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 70.09 -67.02 0.68 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.668 -0.696 . . . . 0.0 113.034 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -169.44 43.08 0.21 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -157.78 138.22 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.938 0.399 . . . . 0.0 110.032 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.457 ' HB2' ' CE3' ' A' ' 461' ' ' TRP . 14.7 t -106.86 130.51 54.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.212 -176.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -161.49 150.68 16.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.168 0.508 . . . . 0.0 112.025 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 37.3 t0 . . . . . 0 C--O 1.245 0.859 0 CA-C-O 118.07 -0.967 . . . . 0.0 109.382 179.595 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.623 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 36.4 m . . . . . 0 N--CA 1.449 -0.49 0 CA-C-O 120.694 0.283 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -73.29 132.24 42.87 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.314 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 70.49 34.42 67.95 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.898 -0.592 . . . . 0.0 113.758 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -88.39 -49.6 6.84 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.332 -0.511 . . . . 0.0 110.731 176.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 105.21 150.84 20.14 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -171.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.01 -41.78 92.88 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.108 0.454 . . . . 0.0 112.104 -171.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -68.06 -38.89 82.96 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.706 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.75 -43.41 65.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.946 0.403 . . . . 0.0 110.415 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 34.2 t -54.76 120.27 6.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.171 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 12.0 tptt -89.28 123.03 33.11 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.0 m -58.92 -50.87 85.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -174.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 456' ' ' SER . 25.2 Cg_endo -61.37 -30.88 88.12 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 121.61 1.54 . . . . 0.0 111.811 178.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.73 -46.18 22.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.371 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 468' ' ' ASP . 66.3 m -148.15 143.23 26.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.102 0.477 . . . . 0.0 110.808 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -79.32 159.16 27.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.69 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.635 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 39.2 t-105 -102.09 124.12 47.14 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -106.71 59.61 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.359 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.49 -55.04 4.08 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.604 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.8 31.41 0.61 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.308 -0.717 . . . . 0.0 111.308 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 40.2 m -143.17 129.09 19.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.507 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.635 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 46.9 t -91.81 117.08 29.44 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.08 134.61 1.6 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . 0.552 ' HB2' ' HA ' ' A' ' 459' ' ' CYS . 32.0 t70 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.362 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.448 ' SG ' ' HD3' ' A' ' 449' ' ' LYS . 11.8 t . . . . . 0 CA--C 1.52 -0.209 0 CA-C-O 122.09 0.948 . . . . 0.0 109.36 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 89.2 tttt -70.6 126.23 29.04 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.146 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 131.97 -30.56 3.19 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.193 -178.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.448 ' HD3' ' SG ' ' A' ' 446' ' ' CYS . 30.9 mtpp -76.07 137.47 40.2 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.257 0.551 . . . . 0.0 111.123 -177.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -78.48 162.25 49.14 Favored Glycine 0 C--O 1.22 -0.728 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.372 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.86 -35.32 76.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.718 0.759 . . . . 0.0 110.648 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -84.16 40.52 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.305 0.574 . . . . 0.0 110.316 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -164.09 -50.39 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.867 -177.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.86 132.83 40.59 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.402 ' C ' ' HD3' ' A' ' 457' ' ' PRO . 21.5 tptm -144.61 45.95 1.38 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.789 0.804 . . . . 0.0 110.779 -171.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.666 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 20.3 m 44.25 44.47 1.55 Allowed Pre-proline 0 C--N 1.314 -0.95 0 CA-C-N 114.084 -1.416 . . . . 0.0 114.266 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.589 ' HD3' ' N ' ' A' ' 456' ' ' SER . 4.5 Cg_endo -82.05 -48.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.921 1.747 . . . . 0.0 110.326 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.471 ' H ' ' HD2' ' A' ' 457' ' ' PRO . 8.5 t70 -148.25 37.9 0.86 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 173.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.666 ' O ' ' HA ' ' A' ' 456' ' ' SER . 4.0 m -148.64 132.66 17.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.85 -172.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.33 136.58 45.81 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.189 177.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.466 ' HE3' ' SG ' ' A' ' 466' ' ' CYS . 32.2 t-105 -85.93 126.45 34.11 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.031 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.59 121.33 9.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.761 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 55.53 45.75 83.34 Favored Glycine 0 N--CA 1.453 -0.191 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.999 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.78 35.94 92.0 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.589 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 60.9 m -155.17 134.22 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -85.52 130.63 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.018 178.686 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -168.28 133.8 1.82 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 60.4 t0 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.964 -0.541 . . . . 0.0 109.773 -179.726 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.68 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 34.3 m . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 120.714 0.292 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 83.1 tttt -56.51 133.33 53.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.628 -177.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 102.18 -28.59 15.25 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.746 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -65.1 144.15 57.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.004 0.43 . . . . 0.0 111.71 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 162.61 54.72 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.457 178.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -59.78 -42.92 94.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.299 0.549 . . . . 0.0 111.051 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -65.83 -36.39 83.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.782 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -75.15 -45.62 39.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.743 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 51.0 t -56.68 119.07 5.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.282 -178.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -81.04 109.44 15.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.517 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.6 m -59.97 -48.66 94.16 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -171.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.0 Cg_endo -58.28 -38.74 89.53 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 121.175 1.25 . . . . 0.0 111.356 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -77.16 -47.99 18.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.4 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.607 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 16.5 m -127.06 132.6 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -79.99 130.82 35.57 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.941 0.401 . . . . 0.0 110.913 -176.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -82.3 122.46 27.98 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -166.44 137.65 3.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.718 0.294 . . . . 0.0 110.485 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 69.77 37.03 75.61 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.453 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 58.12 34.6 73.74 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.393 -0.432 . . . . 0.0 112.773 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 6.1 t -167.68 157.6 10.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.014 0.435 . . . . 0.0 110.119 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.68 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 14.4 t -82.36 120.8 25.89 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.469 -176.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.518 ' O ' ' HB3' ' A' ' 459' ' ' CYS . 74.1 mmtt -90.73 146.51 23.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.751 0.31 . . . . 0.0 111.066 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 40.3 t0 . . . . . 0 C--O 1.246 0.92 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.271 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 73.0 m . . . . . 0 N--CA 1.454 -0.236 0 CA-C-O 120.997 0.427 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.2 tptt -60.33 113.66 2.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.727 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 127.01 -25.56 5.22 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.602 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 454' ' ' CYS . 55.3 mtpt -75.45 141.28 43.17 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 120.933 0.397 . . . . 0.0 111.032 -177.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.31 158.2 50.45 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.961 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . 0.539 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 38.9 tt0 -60.25 -36.9 78.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.962 0.381 . . . . 0.0 111.346 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -83.8 37.83 0.61 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.223 0.535 . . . . 0.0 110.844 178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.496 ' OD2' ' HE3' ' A' ' 449' ' ' LYS . 29.4 t70 -163.52 -50.13 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.909 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.499 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 1.7 t -68.12 125.67 27.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.461 176.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 41.6 mmtm -92.26 135.64 33.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -178.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.5 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 23.1 t -60.56 -50.0 87.47 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 26.7 Cg_exo -62.42 -29.12 78.79 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.632 1.554 . . . . 0.0 111.504 178.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.43 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 38.0 t70 -80.8 -42.32 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.241 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.84 134.47 24.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -66.23 115.87 6.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.941 0.401 . . . . 0.0 111.23 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.539 ' CZ2' ' HB2' ' A' ' 451' ' ' GLU . 48.9 t-105 -85.44 119.38 25.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 172.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -154.58 126.03 7.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.695 0.283 . . . . 0.0 110.734 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.58 33.08 75.74 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.082 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.43 39.21 97.48 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 121.188 -0.53 . . . . 0.0 112.37 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.8 t -165.9 145.16 6.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.1 OUTLIER -86.21 135.51 33.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 -175.571 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -130.88 139.72 50.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.009 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 33.4 t70 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.785 -0.626 . . . . 0.0 109.991 178.778 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.538 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 46.0 m . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 120.718 0.294 . . . . 0.0 110.753 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -62.46 133.5 55.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.372 -175.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.93 53.87 6.08 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.288 176.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.801 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 49.9 mtpt -122.17 -50.71 2.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.994 0.426 . . . . 0.0 111.44 178.238 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 126.53 156.01 9.08 Favored Glycine 0 N--CA 1.444 -0.803 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -172.003 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -61.84 -41.97 98.46 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.323 0.562 . . . . 0.0 111.392 -173.369 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.6 pttm -71.95 -34.78 69.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.624 179.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.801 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -75.51 -40.19 57.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.388 -179.033 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.8 t -59.9 118.62 6.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.176 179.025 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -74.72 123.25 24.58 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.235 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.446 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 46.0 m -71.13 -51.57 10.28 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -173.349 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 456' ' ' SER . 28.6 Cg_endo -63.61 -27.33 69.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.512 1.475 . . . . 0.0 111.871 -179.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -97.39 -33.17 11.51 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.479 -174.278 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.2 m -129.98 150.27 51.34 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 122.127 -0.358 . . . . 0.0 110.974 -172.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.458 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 63.5 mttm -86.87 139.11 30.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.33 -179.119 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.454 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.2 t-105 -111.78 122.74 48.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.539 ' HB3' ' HE3' ' A' ' 467' ' ' LYS . 69.4 tt0 -158.58 134.54 9.04 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.513 0.196 . . . . 0.0 110.866 -175.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.35 31.63 81.05 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.354 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.53 37.83 94.94 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.171 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.8 t -165.35 146.91 7.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.097 0.475 . . . . 0.0 110.711 179.398 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.538 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.7 t -87.11 147.49 25.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.094 -175.22 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.71 142.72 27.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.973 0.416 . . . . 0.0 110.456 178.565 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 C--O 1.254 1.317 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.356 -179.128 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.473 ' HA ' ' HB2' ' A' ' 466' ' ' CYS . 26.5 ttpp -58.62 125.2 22.44 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.349 -175.048 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.1 -20.52 4.49 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.255 -176.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.869 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 29.7 mtpt -93.45 -152.74 0.34 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.224 -178.113 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -127.83 160.94 21.82 Favored Glycine 0 C--O 1.219 -0.794 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.654 177.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -42.6 -43.08 3.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -174.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -64.0 -42.9 97.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.232 -178.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.75 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 46.6 m-20 -73.11 -51.08 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.658 0.742 . . . . 0.0 109.6 175.247 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.869 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 77.5 m -72.6 53.83 0.32 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 124.907 1.283 . . . . 0.0 111.472 177.391 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.604 ' HE2' ' HG2' ' A' ' 457' ' ' PRO . 20.6 ptmt -63.12 141.95 58.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.556 -177.357 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.506 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 7.3 t -50.4 -48.54 80.85 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.568 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.604 ' HG2' ' HE2' ' A' ' 455' ' ' LYS . 13.5 Cg_endo -57.63 -37.38 97.09 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 121.769 1.646 . . . . 0.0 112.621 -179.367 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -85.42 -36.82 20.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 82.0 m -138.54 135.54 35.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.006 -173.026 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.693 ' HB3' ' HB2' ' A' ' 467' ' ' LYS . 83.1 tttt -72.19 143.79 48.76 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 175.076 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.684 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 44.2 t-105 -116.49 126.68 53.7 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.08 -176.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.674 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 41.9 tt0 -95.99 -65.64 0.96 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 0.0 110.896 -179.11 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -179.24 87.34 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 68.56 31.65 73.94 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.744 -175.861 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.4 t -166.2 130.17 2.13 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -179.599 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.684 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 1.7 m -77.99 140.73 39.21 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.098 -177.233 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.693 ' HB2' ' HB3' ' A' ' 460' ' ' LYS . 27.1 mmmt -93.72 171.32 8.96 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.465 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 31.4 t70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.802 -169.6 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.836 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 21.4 m . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.631 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 64.2 tttp -54.57 110.57 0.65 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.754 -176.189 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 112.55 -19.35 21.85 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.747 -0.74 . . . . 0.0 113.096 -178.533 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.8 ' HE3' ' HB3' ' A' ' 453' ' ' ASP . 31.1 mmmt -68.86 142.8 54.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 117.01 0.405 . . . . 0.0 111.335 -178.152 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -68.2 163.32 48.5 Favored Glycine 0 C--O 1.224 -0.502 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 175.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -55.01 -45.09 75.06 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -175.458 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -65.37 -44.84 86.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.898 0.38 . . . . 0.0 110.595 -179.008 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.8 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -67.13 -44.75 79.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.157 179.226 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 33.4 t -64.88 122.12 16.22 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.49 -175.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 68.4 mttm -76.27 122.53 24.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.701 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.512 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 19.4 m -68.39 -50.31 28.4 Favored Pre-proline 0 C--N 1.322 -0.589 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -174.55 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.512 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 21.3 Cg_exo -65.01 -37.58 32.61 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 121.247 1.298 . . . . 0.0 110.974 179.076 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.423 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 7.7 t70 -71.28 -39.54 71.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.368 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 54.6 m -138.65 140.34 38.83 Favored 'General case' 0 N--CA 1.458 -0.053 0 CA-C-O 121.24 0.543 . . . . 0.0 112.091 -174.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.436 ' O ' ' HG2' ' A' ' 467' ' ' LYS . 62.0 tttp -71.17 135.62 47.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.739 -178.17 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.614 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.4 t-105 -100.77 107.89 19.57 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 174.354 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.563 ' HB3' HG22 ' A' ' 465' ' ' THR . 22.8 tt0 -82.7 50.8 1.75 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.019 0.437 . . . . 0.0 110.875 -177.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 54.61 31.68 53.0 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.699 -0.682 . . . . 0.0 113.755 177.931 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 161.45 -40.57 0.4 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.8 179.064 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.563 HG22 ' HB3' ' A' ' 462' ' ' GLU . 9.7 t -115.37 134.56 54.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.247 0.546 . . . . 0.0 110.812 179.72 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.836 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 47.4 t -81.95 140.24 34.13 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.633 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.481 ' CD ' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.34 147.21 30.1 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.417 0.627 . . . . 0.0 111.192 -174.352 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 . . . . . 0 C--N 1.316 -0.88 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.94 -179.473 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.623 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 75.0 m . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 40.8 ttmt -57.67 117.92 4.72 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.011 -176.815 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 56.35 46.32 87.11 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.308 -0.86 . . . . 0.0 113.822 173.842 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.575 ' HD2' ' HA ' ' A' ' 454' ' ' CYS . 12.4 ptpt -90.89 -41.37 11.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 117.203 0.501 . . . . 0.0 111.849 -179.65 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 123.91 151.68 8.24 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.999 -178.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . 0.456 ' C ' ' H ' ' A' ' 453' ' ' ASP . 6.4 tm-20 -66.28 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.563 0.181 . . . . 0.0 111.033 -176.049 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -79.15 38.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.175 0.512 . . . . 0.0 110.52 177.676 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.456 ' H ' ' C ' ' A' ' 451' ' ' GLU . 50.6 t0 -166.22 -43.85 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.496 -178.93 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.575 ' HA ' ' HD2' ' A' ' 449' ' ' LYS . 53.7 t -64.16 112.15 2.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.242 -176.072 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.463 ' HE3' ' HB2' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -170.65 138.24 1.42 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.432 168.911 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.562 ' C ' ' H ' ' A' ' 458' ' ' ASP . 12.2 t 170.04 142.15 0.08 OUTLIER Pre-proline 0 C--N 1.315 -0.928 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.2 -176.254 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.77 8.27 1.04 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 121.603 1.535 . . . . 0.0 110.008 172.753 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.562 ' H ' ' C ' ' A' ' 456' ' ' SER . 87.8 m-20 -115.17 -52.17 2.69 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.992 177.972 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 63.8 m -82.44 131.59 35.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.691 179.74 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.48 141.71 44.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.256 -178.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -85.87 123.51 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.699 176.218 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.576 ' HB3' HG21 ' A' ' 465' ' ' THR . 9.4 tp10 -103.87 55.83 0.73 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.855 0.36 . . . . 0.0 110.711 -176.313 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.62 -52.16 3.11 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.199 -0.524 . . . . 0.0 113.359 179.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -152.2 33.88 0.85 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.09 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.576 HG21 ' HB3' ' A' ' 462' ' ' GLU . 9.5 t -171.4 134.08 0.86 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.881 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.623 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.8 t -91.98 140.66 29.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.286 -0.416 . . . . 0.0 109.911 -176.848 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -168.21 136.56 2.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.159 0.504 . . . . 0.0 111.414 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 56.8 t0 . . . . . 0 C--O 1.248 1.014 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.323 175.674 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.514 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 6.4 t . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -63.37 132.12 50.48 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.436 -175.111 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 138.56 -39.26 1.59 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.87 143.64 56.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.388 -0.406 . . . . 0.0 110.751 179.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.73 166.0 49.74 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 175.2 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . 0.6 ' HG2' ' H ' ' A' ' 452' ' ' LYS . 12.3 pm0 -55.07 -56.76 16.22 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . 0.6 ' H ' ' HG2' ' A' ' 451' ' ' GLU . 1.3 mptm? -71.23 -37.11 72.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.853 0.358 . . . . 0.0 110.638 177.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -63.6 -34.06 76.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.86 -178.152 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.0 115.64 3.0 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.248 176.166 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -84.48 128.23 34.47 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -177.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.611 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 1.9 m -60.27 -54.53 54.24 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -171.909 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 46.6 Cg_exo -57.77 -33.31 96.68 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.733 1.622 . . . . 0.0 111.538 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -77.08 -49.16 15.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.439 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.615 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 25.2 m -151.69 136.36 17.07 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.411 -174.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -86.16 141.05 29.64 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.102 -0.374 . . . . 0.0 110.175 176.531 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -87.43 118.23 26.75 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.265 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.494 ' HB2' ' HE3' ' A' ' 467' ' ' LYS . 81.3 mt-10 -149.63 132.29 15.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.721 0.296 . . . . 0.0 110.998 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 59.17 38.01 92.53 Favored Glycine 0 N--CA 1.452 -0.245 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.517 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.81 38.54 96.12 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.145 -178.561 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 88.4 m -150.94 128.43 11.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.883 0.373 . . . . 0.0 110.945 -176.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.615 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 5.9 t -78.06 126.7 31.2 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.951 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.494 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 22.0 pttp -166.4 149.37 7.03 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.712 -175.549 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.9 t70 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.258 -0.877 . . . . 0.0 109.434 174.753 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.528 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 12.6 t . . . . . 0 N--CA 1.454 -0.251 0 CA-C-O 120.575 0.226 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 17.9 tttp -54.59 124.69 17.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.057 0.455 . . . . 0.0 111.089 -176.029 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 83.07 26.99 42.31 Favored Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.51 -0.768 . . . . 0.0 114.647 173.277 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.891 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 42.6 mtpt -84.05 -25.78 29.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.049 0.925 . . . . 0.0 109.226 170.989 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 96.19 141.14 11.65 Favored Glycine 0 C--O 1.215 -1.071 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.619 -177.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -45.34 -43.74 11.1 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -171.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -57.89 -43.69 86.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.062 0.458 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.707 ' OD2' ' HE2' ' A' ' 449' ' ' LYS . 23.6 t0 -81.5 -45.3 16.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.332 179.524 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.891 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 70.9 m -71.64 64.58 0.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.892 1.277 . . . . 0.0 111.331 174.986 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -65.72 145.4 56.06 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.817 -178.102 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.518 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.0 m -56.2 -48.37 97.01 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -175.77 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.3 Cg_endo -62.31 -33.05 81.6 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 121.491 1.461 . . . . 0.0 111.712 177.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -79.96 -40.97 26.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.145 -178.469 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 97.9 m -146.14 142.24 28.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.512 -176.308 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -75.2 125.21 28.49 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.851 0.358 . . . . 0.0 110.791 179.367 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.711 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 26.9 t-105 -96.44 115.93 28.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.696 178.966 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -89.07 -47.37 8.15 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.922 0.391 . . . . 0.0 110.907 -178.381 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.76 65.85 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 82.69 37.94 12.85 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.513 -174.137 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -167.56 136.7 2.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.739 0.304 . . . . 0.0 110.393 178.569 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.711 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.0 OUTLIER -102.15 138.9 38.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.194 -176.405 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -172.93 -173.29 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.919 0.39 . . . . 0.0 110.614 176.796 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 31.7 t70 . . . . . 0 C--O 1.248 1.002 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.33 176.404 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.471 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 57.6 m . . . . . 0 N--CA 1.451 -0.376 0 CA-C-O 120.747 0.308 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -64.74 128.38 35.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.113 0.482 . . . . 0.0 110.999 -175.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.78 22.2 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.496 -0.774 . . . . 0.0 113.25 177.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 446' ' ' CYS . 43.4 mtpt -99.04 -48.82 4.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.128 0.489 . . . . 0.0 110.406 174.127 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 102.75 153.61 24.6 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -175.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.04 -39.92 83.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.88 0.34 . . . . 0.0 111.434 -177.499 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -86.57 37.6 0.75 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.249 0.547 . . . . 0.0 111.08 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -157.06 -45.93 0.07 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.333 -0.848 . . . . 0.0 108.889 177.513 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.1 t -63.22 115.91 4.96 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.199 175.003 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.448 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 94.8 mttt -101.74 141.06 35.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.573 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.477 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 22.1 m -56.13 -50.47 87.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.282 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 456' ' ' SER . 32.8 Cg_endo -63.33 -31.64 73.11 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.535 1.49 . . . . 0.0 110.942 177.339 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.448 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 14.6 t70 -71.32 -52.38 19.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.715 179.56 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.479 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 70.8 m -156.65 147.52 21.86 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -178.8 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -81.1 122.87 27.88 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.817 -176.345 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -87.56 106.64 18.14 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 174.383 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -146.62 130.31 16.99 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -174.664 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.18 32.42 84.12 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.788 -175.016 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.48 24.01 69.02 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.282 -177.479 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 57.0 m -132.18 133.75 44.57 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 120.797 0.332 . . . . 0.0 110.459 -177.65 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 31.2 t -88.96 118.77 28.93 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.343 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -161.72 144.61 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -174.587 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . 0.442 ' O ' ' HA ' ' A' ' 459' ' ' CYS . 9.8 t70 . . . . . 0 C--O 1.245 0.844 0 O-C-N 124.311 1.007 . . . . 0.0 110.972 -179.26 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.559 ' O ' ' HE2' ' A' ' 449' ' ' LYS . 57.9 m . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.693 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 63.5 tttp 59.08 144.97 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.887 0.875 . . . . 0.0 112.844 176.706 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . 0.517 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . -73.14 51.86 1.7 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.857 179.311 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.559 ' HE2' ' O ' ' A' ' 446' ' ' CYS . 33.6 mtmt -74.48 -152.21 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 179.773 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -83.26 156.23 33.59 Favored Glycine 0 N--CA 1.443 -0.88 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 174.234 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -41.07 98.53 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.685 0.279 . . . . 0.0 111.301 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -69.05 -34.05 74.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.835 0.35 . . . . 0.0 110.51 179.942 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.33 -51.83 27.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.663 176.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 16.0 t -53.67 129.84 34.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.032 174.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.97 116.81 23.58 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 173.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.564 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 25.0 m -65.93 -47.04 64.92 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.413 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.1 Cg_endo -57.98 -38.44 92.05 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.667 1.578 . . . . 0.0 111.645 177.591 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -76.76 -48.22 19.34 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.175 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.468 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 60.6 m -130.4 142.54 50.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 111.189 -175.178 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -76.95 133.98 39.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.072 0.463 . . . . 0.0 110.99 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -102.98 119.84 39.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.479 176.512 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.56 ' O ' HG21 ' A' ' 465' ' ' THR . 14.1 pt-20 -159.94 143.68 14.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.686 0.279 . . . . 0.0 110.674 178.684 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.17 32.1 79.33 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.285 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.13 41.82 99.63 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.975 179.375 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.56 HG21 ' O ' ' A' ' 462' ' ' GLU . 14.7 t -160.4 146.89 15.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.012 0.434 . . . . 0.0 110.496 178.963 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.693 ' HB3' ' O ' ' A' ' 447' ' ' LYS . 20.6 t -97.48 121.25 39.16 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.711 -176.748 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -133.56 141.85 47.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.792 0.33 . . . . 0.0 111.576 -175.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.519 -0.753 . . . . 0.0 109.718 175.036 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.474 ' SG ' ' HD2' ' A' ' 449' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -55.1 113.0 1.19 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.909 0.385 . . . . 0.0 110.982 -174.713 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.83 -30.86 3.03 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.295 -174.51 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.474 ' HD2' ' SG ' ' A' ' 446' ' ' CYS . 96.0 mttt -63.93 140.41 58.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.733 -0.233 . . . . 0.0 110.996 178.429 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.52 172.67 47.89 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 171.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.82 -41.73 78.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.277 0.539 . . . . 0.0 111.101 -178.594 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -71.57 -41.75 68.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.487 -178.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.62 -35.57 80.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.293 0.568 . . . . 0.0 110.451 177.008 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 15.9 t -68.37 109.16 3.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.522 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -85.18 126.92 34.04 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.524 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -59.4 -49.58 91.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -175.725 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.4 Cg_endo -61.0 -33.21 92.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.716 1.611 . . . . 0.0 111.67 178.659 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -78.04 -45.39 23.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.505 -179.681 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.426 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 57.6 m -146.87 143.14 28.34 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 -178.901 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.49 ' O ' ' HD3' ' A' ' 467' ' ' LYS . 16.4 ptpt -86.41 135.54 33.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.205 0.526 . . . . 0.0 110.798 178.237 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 77.2 t-105 -95.28 121.14 36.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.52 -175.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.762 ' HB2' ' HZ3' ' A' ' 467' ' ' LYS . 18.1 tt0 -81.52 -135.72 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.485 178.56 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.81 -43.1 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.317 177.1 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.28 44.68 0.55 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.549 -0.621 . . . . 0.0 111.549 179.542 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.404 ' O ' HG22 ' A' ' 465' ' ' THR . 14.6 t -162.29 136.19 6.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.368 0.604 . . . . 0.0 110.554 178.684 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 35.5 t -96.29 134.9 38.84 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.47 -0.786 . . . . 0.0 108.943 178.415 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.762 ' HZ3' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -153.0 135.07 14.8 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.911 -0.716 . . . . 0.0 111.715 -178.113 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 23.2 t70 . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.486 -179.807 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.553 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 2.4 t . . . . . 0 N--CA 1.463 0.182 0 CA-C-O 121.354 0.597 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 62.0 tttp -75.76 128.17 34.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.176 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 133.22 -37.93 1.93 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.281 179.3 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.271 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.33 179.42 25.08 Favored Glycine 0 C--O 1.226 -0.359 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.7 175.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.98 -43.75 94.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.219 0.51 . . . . 0.0 111.558 -176.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.93 -40.47 91.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.044 0.45 . . . . 0.0 110.354 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -69.95 -41.01 75.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.912 -179.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.5 114.12 2.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.098 -177.355 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 49.8 mtmt -72.6 117.23 14.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 176.048 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.499 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.7 t -64.59 -50.35 65.68 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -173.883 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 456' ' ' SER . 29.6 Cg_endo -61.47 -29.81 85.68 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.632 1.555 . . . . 0.0 111.649 178.514 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 1.0 OUTLIER -85.35 -40.91 15.97 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.221 -176.032 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.49 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 9.2 m -137.88 144.66 41.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.678 0.275 . . . . 0.0 110.452 -174.629 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . 0.429 ' HD2' ' N ' ' A' ' 460' ' ' LYS . 4.4 mptp? -80.9 148.02 30.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.089 0.471 . . . . 0.0 110.532 178.67 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -107.43 123.02 47.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.454 178.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.477 ' HG2' ' H ' ' A' ' 463' ' ' GLY . 22.9 tt0 -85.33 -136.67 0.06 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 177.268 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . 0.477 ' H ' ' HG2' ' A' ' 462' ' ' GLU . . . -73.88 -42.76 36.93 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 110.904 -0.879 . . . . 0.0 110.904 175.132 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.99 42.59 0.48 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 177.456 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 91.2 m -148.47 129.19 14.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.811 0.339 . . . . 0.0 110.943 -176.96 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.553 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 8.7 t -83.6 135.79 34.48 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.139 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -159.78 134.89 8.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.467 0.651 . . . . 0.0 111.887 -179.659 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.684 178.12 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 63.8 m . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 120.695 0.283 . . . . 0.0 110.592 . . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -71.85 125.67 27.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 110.595 -177.004 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 130.08 -29.57 3.68 Favored Glycine 0 N--CA 1.441 -0.971 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.315 -178.803 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.527 ' HB2' ' CB ' ' A' ' 453' ' ' ASP . 9.8 pttm -97.45 139.11 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.638 178.942 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.22 -168.88 14.54 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.418 -174.76 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.32 -40.87 90.2 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 122.658 0.383 . . . . 0.0 111.484 -176.785 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . 0.528 ' HB3' ' HZ1' ' A' ' 452' ' ' LYS . 2.8 mmmp? -62.5 -41.52 98.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.154 0.502 . . . . 0.0 110.119 178.071 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.527 ' CB ' ' HB2' ' A' ' 449' ' ' LYS . 90.6 m-20 -73.73 -41.61 62.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.528 -179.411 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 7.8 t -63.41 118.76 8.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.84 -176.038 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -156.65 172.97 17.64 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.545 -178.779 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.458 ' C ' ' H ' ' A' ' 458' ' ' ASP . 5.9 t 68.58 147.61 0.11 Allowed Pre-proline 0 C--O 1.226 -0.159 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.178 175.11 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.433 ' HD2' ' OG ' ' A' ' 456' ' ' SER . 27.3 Cg_endo -61.64 -1.56 2.11 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.507 2.138 . . . . 0.0 111.748 177.684 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.458 ' H ' ' C ' ' A' ' 456' ' ' SER . 3.0 m-20 -72.35 -37.28 68.88 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.1 174.949 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.473 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 79.8 m -135.64 131.86 36.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.367 177.081 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -105.96 133.39 50.75 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.979 -177.818 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -85.82 132.68 34.06 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 174.689 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -157.31 128.98 6.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.056 -0.257 . . . . 0.0 111.01 -178.132 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.54 -70.59 0.37 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.015 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -175.57 31.69 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 177.471 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.1 m -151.23 134.85 16.32 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -177.014 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 17.0 t -84.97 125.82 33.01 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.049 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 446' ' ' CYS . 22.5 pttp -156.79 144.01 18.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.671 0.272 . . . . 0.0 111.065 -176.247 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.887 -176.987 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.785 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 73.2 m . . . . . 0 N--CA 1.439 -0.997 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -67.42 105.67 1.87 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.104 179.872 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 137.52 -28.19 2.79 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.213 -179.643 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -86.6 154.34 21.12 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.416 -176.902 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.57 177.44 30.06 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.83 -176.253 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.01 -50.74 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.844 -0.209 . . . . 0.0 110.973 -177.9 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -68.18 -31.07 70.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.936 0.398 . . . . 0.0 110.535 179.55 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.55 -34.73 72.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.02 178.571 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 48.9 t -60.12 116.76 4.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.23 179.842 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.453 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 35.9 mtmm -81.04 124.78 29.46 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.709 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 9.6 m -62.93 -54.08 49.92 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -172.418 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.5 Cg_endo -62.08 -28.37 80.05 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.475 1.45 . . . . 0.0 111.235 178.976 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.453 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 45.3 t0 -75.03 -50.96 14.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.972 178.089 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.48 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 98.2 m -148.54 148.39 30.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.404 0.621 . . . . 0.0 111.509 -175.169 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -92.35 139.58 30.45 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.282 177.241 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 48.9 t-105 -77.2 119.78 21.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.158 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -149.3 130.42 14.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.84 0.352 . . . . 0.0 110.454 -176.587 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.75 38.27 91.66 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.377 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.95 84.01 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.258 -0.496 . . . . 0.0 112.313 -177.815 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 85.9 m -150.82 135.84 17.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.695 0.283 . . . . 0.0 110.287 -177.002 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.785 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 20.0 t -78.63 124.94 28.7 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -161.39 134.28 6.21 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.137 0.494 . . . . 0.0 111.39 -174.907 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . 0.419 ' HB3' ' HA ' ' A' ' 459' ' ' CYS . 29.4 p-10 . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.642 177.91 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.865 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 81.9 m . . . . . 0 N--CA 1.453 -0.286 0 CA-C-O 120.797 0.332 . . . . 0.0 110.425 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 1.1 tmtp? -52.76 127.41 23.18 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.543 -178.795 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 108.89 -28.57 11.03 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.606 -178.868 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.865 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 57.0 mtmt -72.28 144.68 48.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.793 0.296 . . . . 0.0 111.132 -178.888 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.84 175.25 34.92 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 175.935 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.52 -37.09 74.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 117.346 0.573 . . . . 0.0 111.459 -177.253 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -68.6 -41.67 79.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.234 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . 0.605 ' HB3' ' HD2' ' A' ' 449' ' ' LYS . 1.1 m-20 -75.96 -36.87 59.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 110.56 178.852 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.48 ' SG ' ' N ' ' A' ' 455' ' ' LYS . 36.9 t -77.55 -157.73 0.1 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.351 179.589 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 454' ' ' CYS . 27.7 mmmt 61.36 49.67 5.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.862 0.839 . . . . 0.0 110.749 -175.282 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.516 ' C ' ' H ' ' A' ' 458' ' ' ASP . 0.9 OUTLIER -71.77 171.72 8.59 Favored Pre-proline 0 C--N 1.31 -1.127 0 CA-C-N 114.438 -1.255 . . . . 0.0 108.974 176.06 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.57 29.07 0.43 Allowed 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.102 1.868 . . . . 0.0 111.097 175.949 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . 0.516 ' H ' ' C ' ' A' ' 456' ' ' SER . 49.6 t0 -158.52 -49.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.489 -179.121 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 69.3 m -79.34 137.54 37.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.991 -179.484 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -115.22 160.48 19.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.306 0.574 . . . . 0.0 111.594 -178.563 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.439 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 37.1 t-105 -91.46 136.27 33.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.79 179.202 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 465' ' ' THR . 36.8 tt0 -128.24 75.38 1.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.944 0.402 . . . . 0.0 111.691 -177.59 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 60.78 57.96 16.19 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.756 175.383 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 78.99 40.79 15.69 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.947 178.762 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 462' ' ' GLU . 6.3 t -166.87 143.12 4.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 175.334 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 36.6 t -98.91 139.73 34.13 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.576 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.426 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 21.9 pttp -153.54 152.13 30.58 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.993 0.425 . . . . 0.0 111.103 -178.363 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.337 175.251 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.742 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 59.0 m . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -56.01 107.71 0.38 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.31 -173.65 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 78.32 56.07 3.8 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.673 -0.694 . . . . 0.0 113.875 177.297 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 446' ' ' CYS . 14.5 ptpt -129.57 166.79 19.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.219 0.51 . . . . 0.0 110.692 173.451 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 165.11 54.68 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.086 -177.781 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.45 -35.11 78.57 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.318 0.247 . . . . 0.0 111.104 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 39.25 0.71 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.643 0.735 . . . . 0.0 110.388 176.694 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -156.28 -44.51 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.576 -178.566 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.48 129.46 39.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.039 176.507 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . 0.443 ' HZ3' ' HB2' ' A' ' 455' ' ' LYS . 8.8 mtmp? -106.73 117.76 34.91 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.325 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 26.1 t -56.95 -48.43 97.43 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -173.601 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.2 Cg_endo -58.01 -30.13 89.05 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.625 1.55 . . . . 0.0 112.187 -179.227 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -87.95 -45.08 10.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.156 -179.842 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 456' ' ' SER . 68.4 m -143.13 142.08 31.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.947 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -89.05 147.23 24.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.731 0.777 . . . . 0.0 112.008 -175.265 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -94.82 119.52 33.54 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.345 179.615 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -146.07 129.89 17.2 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.572 0.225 . . . . 0.0 110.756 -179.161 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.67 42.68 96.37 Favored Glycine 0 N--CA 1.454 -0.152 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.221 -178.929 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 57.18 34.71 67.52 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.061 -177.025 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 32.7 m -143.93 130.72 20.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.715 0.293 . . . . 0.0 110.874 -175.038 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.742 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.1 t -88.64 134.61 33.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.98 178.654 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -172.53 154.34 3.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 111.229 -179.448 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 7.6 t70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.306 -0.854 . . . . 0.0 109.478 175.057 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.77 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 70.8 m . . . . . 0 N--CA 1.451 -0.392 0 CA-C-O 120.624 0.25 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -61.58 130.87 48.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -173.323 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.5 17.01 79.81 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.52 -0.763 . . . . 0.0 114.4 175.187 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 449' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 50.8 mtmt -93.19 137.94 32.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 117.972 0.886 . . . . 0.0 110.327 173.868 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.47 166.18 51.29 Favored Glycine 0 C--O 1.223 -0.538 0 C-N-CA 121.018 -0.611 . . . . 0.0 111.854 178.622 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 451' ' ' GLU . . . . . 0.431 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 37.1 tt0 -59.26 -34.71 72.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.033 0.444 . . . . 0.0 111.635 -177.218 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -69.67 -44.38 70.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.803 0.335 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.54 -44.35 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.603 -179.015 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 454' ' ' CYS . . . . . 0.531 ' SG ' ' HE3' ' A' ' 449' ' ' LYS . 0.3 OUTLIER -80.29 115.9 20.08 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.305 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -87.95 148.05 24.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 178.773 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 456' ' ' SER . . . . . 0.484 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -62.96 -51.75 68.69 Favored Pre-proline 0 C--N 1.322 -0.606 0 O-C-N 123.347 0.404 . . . . 0.0 111.605 -179.845 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 457' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.1 Cg_endo -61.81 -30.98 85.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.599 1.533 . . . . 0.0 111.46 176.584 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -71.71 -47.99 50.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.008 178.357 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 63.4 m -148.55 143.12 26.42 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.157 -173.584 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.02 124.28 23.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.956 0.408 . . . . 0.0 110.781 -178.303 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 461' ' ' TRP . . . . . 0.592 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 60.3 t-105 -107.08 126.56 52.51 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.685 178.339 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 462' ' ' GLU . . . . . 0.871 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 21.3 tt0 -90.61 -60.5 1.9 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.975 0.417 . . . . 0.0 110.133 -179.176 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 176.55 40.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 178.286 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 147.55 -41.78 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -176.215 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.6 m -104.84 134.17 48.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.469 -0.365 . . . . 0.0 111.311 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 466' ' ' CYS . . . . . 0.592 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 1.8 t -101.09 145.1 29.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.971 178.666 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 467' ' ' LYS . . . . . 0.871 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 0.5 OUTLIER -148.16 140.17 24.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.123 0.487 . . . . 0.0 111.53 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 5.9 t70 . . . . . 0 C--O 1.251 1.158 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.507 179.676 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 18.4 m -67.64 123.58 20.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.651 0.262 . . . . 0.0 110.626 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -167.11 -31.93 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.173 -175.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -149.52 -35.31 0.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.999 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 24.8 m 59.19 37.36 23.91 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.03 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 24.7 pttm -175.4 -34.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.782 176.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 24.2 m 68.59 135.97 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.75 0.656 . . . . 0.0 111.874 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -62.03 -48.6 82.24 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.816 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 16.7 m -88.57 147.09 38.78 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-O 120.611 0.243 . . . . 0.0 110.755 175.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -62.52 -31.56 80.2 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.818 2.346 . . . . 0.0 112.201 -178.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 12.1 t 60.32 52.36 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-O 121.377 0.608 . . . . 0.0 110.368 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 28.1 m -65.05 126.68 28.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.849 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -79.61 -53.42 6.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.556 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 4.9 t -171.58 141.31 1.47 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.637 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -142.98 47.76 1.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.554 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 11.9 t 42.99 48.07 5.07 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.864 0.84 . . . . 0.0 111.955 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.78 -29.14 68.26 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.867 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -68.35 -44.03 76.17 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.186 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . 0.42 ' C ' ' H ' ' A' ' 441' ' ' THR . . . -66.85 153.42 43.48 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.692 0.282 . . . . 0.0 110.874 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.1 36.86 0.24 Allowed 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.063 178.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.42 ' H ' ' C ' ' A' ' 439' ' ' ALA . 88.6 m 69.37 -57.91 0.52 Allowed 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.437 0.695 . . . . 0.0 111.361 -177.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.6 m -154.54 103.54 2.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . 0.515 ' C ' ' H ' ' A' ' 445' ' ' LYS . . . -75.51 84.98 2.59 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.592 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -76.1 28.07 0.12 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.154 0.502 . . . . 0.0 111.897 -178.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.515 ' H ' ' C ' ' A' ' 443' ' ' ALA . 34.9 mmtp -89.37 -25.49 21.55 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.416 169.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.411 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 57.0 m -73.34 -45.12 57.05 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.786 175.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 14.3 tptm -60.73 118.15 6.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.598 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.52 -25.87 8.88 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.146 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.575 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 68.4 mttm -69.33 144.02 53.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.61 0.243 . . . . 0.0 111.565 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -77.79 176.12 53.98 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 171.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -56.31 -44.34 79.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.858 0.329 . . . . 0.0 111.24 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -64.91 -40.63 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.575 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 47.2 m-20 -69.33 -43.62 73.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.711 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 8.7 t -60.93 111.32 1.62 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.733 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 95.0 mttt -82.95 127.03 33.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.547 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 69.8 m -61.39 -49.0 89.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.547 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -58.37 -28.3 84.45 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 121.796 1.664 . . . . 0.0 111.96 177.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.638 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 0.7 OUTLIER -86.87 -45.67 10.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.991 -178.219 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.1 m -140.77 146.63 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.73 -172.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.477 ' HG3' ' HG3' ' A' ' 462' ' ' GLU . 24.7 tptp -88.7 112.9 23.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.478 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -83.87 106.92 15.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.477 ' HG3' ' HG3' ' A' ' 460' ' ' LYS . 51.4 mt-10 -138.42 132.33 31.22 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.154 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.19 41.39 99.47 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.685 -0.688 . . . . 0.0 112.836 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.06 36.29 92.09 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.319 -0.467 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 89.1 m -149.97 129.23 12.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.787 0.327 . . . . 0.0 110.511 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 22.8 t -87.53 126.51 34.96 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.473 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 52.1 pttt -151.4 142.57 23.22 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.569 0.699 . . . . 0.0 112.146 -174.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 C--O 1.247 0.972 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.446 175.791 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.725 0 N-CA-C 112.158 -0.377 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 7.9 m -90.34 -38.37 13.4 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.831 0.348 . . . . 0.0 110.881 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.758 ' HE2' ' HA ' ' A' ' 423' ' ' LYS . 10.8 mmpt? -66.19 130.39 43.07 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.819 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -89.09 45.43 1.29 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.992 -177.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 425' ' ' SER . . . . . 0.767 ' HB2' HG12 ' A' ' 429' ' ' VAL . 24.6 m -77.59 116.53 18.22 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 176.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 46.3 tttp -76.0 -46.78 27.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.793 -172.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 21.3 m -82.76 49.24 1.45 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.692 0.282 . . . . 0.0 111.246 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 76.34 133.72 0.5 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.127 -0.558 . . . . 0.0 112.578 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.767 HG12 ' HB2' ' A' ' 425' ' ' SER . 15.4 m -80.53 127.23 76.42 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-O 120.958 0.408 . . . . 0.0 110.732 178.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 2.6 Cg_exo -75.37 49.66 2.42 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.291 2.66 . . . . 0.0 111.498 178.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 8.1 p -80.0 39.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 121.711 0.767 . . . . 0.0 111.324 -175.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.4 m -78.6 53.34 1.31 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.69 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.584 ' HA ' HG23 ' A' ' 441' ' ' THR . 74.8 mt-30 -149.91 25.56 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.112 -178.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' THR . . . . . 0.454 ' HB ' ' O ' ' A' ' 437' ' ' ALA . 8.4 m -83.71 135.9 34.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.871 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -76.6 130.12 37.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.288 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 24.2 m 72.0 -59.23 0.56 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.392 0.677 . . . . 0.0 112.146 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 434' ' ' THR . . . -72.94 104.75 4.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.74 0.305 . . . . 0.0 110.78 179.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 69.16 46.28 58.63 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 -176.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -75.76 41.27 0.2 Allowed 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -177.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -72.19 -30.42 64.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.279 0.561 . . . . 0.0 110.258 175.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.584 HG23 ' HA ' ' A' ' 433' ' ' GLN . 1.4 t -63.73 -37.45 87.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.648 176.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 25.2 m -75.73 124.57 27.49 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.31 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -88.41 78.3 7.94 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 172.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -64.5 120.82 13.02 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.994 0.902 . . . . 0.0 111.026 -169.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -146.55 -39.06 0.22 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.311 -1.313 . . . . 0.0 108.127 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.68 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 42.5 m -71.6 -33.48 69.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.465 172.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -53.0 128.46 27.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.266 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 100.33 -22.76 38.59 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.023 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -71.04 137.46 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.959 0.409 . . . . 0.0 112.097 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.22 176.75 49.5 Favored Glycine 0 N--CA 1.444 -0.788 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 171.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -63.89 -43.4 96.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 117.193 0.497 . . . . 0.0 110.413 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.507 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 10.2 mptt -82.45 37.5 0.51 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.368 0.604 . . . . 0.0 111.016 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.73 -41.66 0.1 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.6 t -54.68 108.52 0.4 Allowed 'General case' 0 C--O 1.237 0.406 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.463 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 458' ' ' ASP . 0.3 OUTLIER -71.11 126.97 31.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.108 178.44 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.518 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.6 m -67.55 -46.99 47.44 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.838 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 456' ' ' SER . 24.8 Cg_endo -61.83 -36.21 74.44 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.187 1.258 . . . . 0.0 111.772 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.457 ' HB2' ' HB3' ' A' ' 455' ' ' LYS . 9.3 m-20 -79.47 -39.82 31.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.177 -178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 10.3 m -133.35 -148.63 0.34 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.962 -171.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.51 ' HG3' ' HB2' ' A' ' 467' ' ' LYS . 9.9 ptpp? -167.51 149.13 5.63 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -97.94 133.19 42.76 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.506 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -139.86 122.69 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.41 -92.66 0.13 Allowed Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 -176.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -147.62 36.07 1.18 Allowed Glycine 0 N--CA 1.439 -1.147 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 1.9 p -140.62 144.15 35.59 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.293 0.568 . . . . 0.0 112.332 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.68 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 19.6 t -81.7 109.48 16.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.72 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.637 ' HA ' ' HE2' ' A' ' 467' ' ' LYS . 10.5 mmpt? -85.96 139.16 31.44 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.559 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.251 176.741 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.833 0 N-CA-C 111.88 -0.488 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 2.9 m -125.19 46.44 2.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.248 0.547 . . . . 0.0 110.767 -177.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -79.8 124.8 28.95 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -61.35 114.55 3.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.829 -176.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 425' ' ' SER . . . . . 0.827 ' HB2' ' HD3' ' A' ' 430' ' ' PRO . 43.5 t -173.81 137.62 0.6 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.512 -176.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -67.86 -43.3 79.78 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 176.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 73.8 m -169.14 139.32 2.23 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.016 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 108.79 -41.93 2.09 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.245 -0.979 . . . . 0.0 113.574 177.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.41 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 86.8 t 69.98 122.33 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 123.003 0.521 . . . . 0.0 110.998 -176.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.827 ' HD3' ' HB2' ' A' ' 425' ' ' SER . 52.2 Cg_exo -57.96 -53.18 4.64 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.941 2.427 . . . . 0.0 112.912 -176.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 34.5 m -86.06 9.12 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.769 0.319 . . . . 0.0 111.246 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 61.7 p 48.46 -141.33 0.59 Allowed 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.102 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 50.8 -95.4 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.292 0.637 . . . . 0.0 111.721 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 8.5 m 72.78 -58.29 0.6 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.628 0.771 . . . . 0.0 111.756 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -167.92 132.1 1.73 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 9.0 t -168.36 29.81 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.193 0.521 . . . . 0.0 110.474 -177.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.65 -48.86 35.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.171 176.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -87.82 -37.87 7.73 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.125 173.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 56.8 -141.7 0.79 Allowed 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.975 0.456 . . . . 0.0 110.675 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -127.39 40.33 3.72 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.642 0.734 . . . . 0.0 109.86 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.08 49.88 1.73 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.707 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.416 ' C ' ' H ' ' A' ' 444' ' ' GLU . 34.1 m 66.14 86.58 0.13 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.659 -176.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -75.64 42.12 0.22 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.212 178.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.464 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 13.3 tp10 -67.51 121.01 14.9 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.813 -178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -74.53 -28.81 61.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.288 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.464 ' SG ' ' HG3' ' A' ' 444' ' ' GLU . 20.0 p -70.52 -30.85 67.73 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.3 tttm -61.43 105.24 0.49 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.592 173.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 136.74 -32.88 2.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.897 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 9.9 mmmm -65.76 142.45 57.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.273 . . . . 0.0 110.292 177.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.73 -176.85 22.46 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.141 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.53 -45.21 94.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.899 0.349 . . . . 0.0 111.19 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -71.29 -42.08 69.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 110.557 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.897 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.8 OUTLIER -65.03 -31.42 72.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.369 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.415 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 9.7 t -70.42 89.18 0.68 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.21 0.528 . . . . 0.0 109.736 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -83.97 147.4 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.189 -176.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.48 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 15.4 m -60.77 -48.57 92.64 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.48 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 17.4 Cg_exo -64.66 -27.2 60.8 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.583 1.522 . . . . 0.0 111.487 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -82.47 -40.97 20.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.515 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.471 ' SG ' ' N ' ' A' ' 460' ' ' LYS . 22.1 t -162.99 -151.54 0.19 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.263 0.554 . . . . 0.0 111.103 -171.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.471 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 42.4 mmtm -147.2 127.67 14.07 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.577 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.415 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 67.0 t-105 -88.69 118.44 28.37 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -75.62 -72.21 0.33 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -178.2 41.09 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 155.32 -33.03 0.65 Allowed Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -176.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 28.0 m -132.46 136.89 47.01 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 120.874 0.369 . . . . 0.0 110.545 -179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 8.2 t -75.28 144.24 42.6 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -177.27 126.97 0.15 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.387 0.613 . . . . 0.0 111.229 -176.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.572 -178.321 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 111.596 -0.602 . . . . 0.0 111.596 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 422' ' ' THR . . . . . 0.467 ' HB ' ' H ' ' A' ' 423' ' ' LYS . 15.0 p -128.66 -143.02 0.26 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.649 0.224 . . . . 0.0 110.822 178.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.467 ' H ' ' HB ' ' A' ' 422' ' ' THR . 58.1 mtpt -74.74 -36.2 62.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.791 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 62.11 38.61 13.71 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.594 0.711 . . . . 0.0 109.775 -174.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.82 133.11 44.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.297 -177.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -67.41 -36.94 82.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.802 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 6.7 m 57.88 42.1 23.64 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.453 178.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 75.45 -59.99 2.84 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.059 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 4.9 m -139.93 121.89 9.83 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-O 121.006 0.431 . . . . 0.0 110.186 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.05 135.02 33.54 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.505 2.136 . . . . 0.0 111.984 -178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 7.5 p -149.61 58.16 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 122.088 0.947 . . . . 0.0 109.368 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 3.4 m 74.92 139.13 0.06 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.566 -176.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -72.12 53.17 0.26 Allowed 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -175.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 8.4 t -97.38 50.78 1.07 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.918 0.866 . . . . 0.0 109.811 174.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -81.89 -123.91 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.56 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 7.3 m -62.75 -50.18 72.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.003 0.43 . . . . 0.0 110.032 175.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -83.77 147.37 27.64 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.229 173.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -64.16 146.53 50.41 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.184 -0.532 . . . . 0.0 112.522 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -64.44 142.75 58.31 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 122.152 0.181 . . . . 0.0 111.075 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -75.25 66.71 1.77 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.168 0.509 . . . . 0.0 110.644 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 7.3 t -69.18 -30.81 69.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.169 -177.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.557 HG21 ' HB2' ' A' ' 467' ' ' LYS . 26.0 m -56.01 121.76 10.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.808 -176.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -78.06 132.67 37.84 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.803 175.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.869 ' HA ' ' HB3' ' A' ' 447' ' ' LYS . 34.5 tt0 -98.2 37.31 1.46 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.663 0.744 . . . . 0.0 111.315 -175.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -85.82 -40.53 15.91 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 169.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.435 ' HB3' ' SG ' ' A' ' 454' ' ' CYS . 17.4 m -93.38 -33.86 13.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.12 174.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.869 ' HB3' ' HA ' ' A' ' 444' ' ' GLU . 16.1 tppt? -58.6 117.36 4.45 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 178.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 121.03 -28.99 5.91 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.969 -175.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -73.1 146.5 45.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.683 0.277 . . . . 0.0 111.339 -179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -81.76 173.72 53.81 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.59 173.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -63.6 -33.16 75.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' A' ' 452' ' ' LYS . 13.4 ptmm? -83.12 35.47 0.49 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.257 0.551 . . . . 0.0 111.269 177.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -160.08 -50.92 0.05 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.631 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.435 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.5 OUTLIER -72.46 120.6 18.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.027 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.475 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 16.4 ptpt -75.39 122.03 23.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.314 178.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' SER . . . . . . . . . . . . . 21.1 m -69.57 -44.78 25.42 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -173.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.22 -40.61 81.38 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.179 1.253 . . . . 0.0 111.531 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.475 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 27.5 t70 -80.68 -43.46 20.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.753 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 88.3 m -121.6 133.88 55.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.164 0.507 . . . . 0.0 111.233 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.658 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 46.4 mttt -64.73 138.57 58.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.096 -176.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.449 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 61.3 t-105 -119.31 129.44 54.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.317 175.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -170.15 131.97 1.03 Allowed 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.214 0.321 . . . . 0.0 110.717 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 63.34 36.82 93.91 Favored Glycine 0 CA--C 1.517 0.192 0 CA-C-N 116.173 -0.467 . . . . 0.0 113.256 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.14 39.76 97.59 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.768 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.4 t -161.77 139.92 9.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.449 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 1.6 t -91.79 144.12 25.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.185 -176.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.658 ' HG2' ' HB2' ' A' ' 460' ' ' LYS . 0.0 OUTLIER -149.42 146.86 27.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.647 0.26 . . . . 0.0 110.811 -178.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 50.1 t0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.688 -0.672 . . . . 0.0 109.593 179.501 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.719 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.7 t -162.76 143.64 9.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.552 0.176 . . . . 0.0 110.64 -176.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 64.1 tttp 73.43 -51.81 0.7 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.792 0.837 . . . . 0.0 111.772 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 56.78 60.35 3.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.984 0.421 . . . . 0.0 111.28 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.7 m -60.27 137.77 58.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.752 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -79.5 55.55 1.98 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.347 0.594 . . . . 0.0 110.543 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 54.2 m -158.53 139.77 13.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.247 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -158.93 45.7 0.45 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.805 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.769 ' HB ' ' HD3' ' A' ' 430' ' ' PRO . 26.0 t -69.97 -56.5 7.31 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -178.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.769 ' HD3' ' HB ' ' A' ' 429' ' ' VAL . 17.8 Cg_endo -99.23 -142.96 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 123.996 3.131 . . . . 0.0 112.547 -176.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.451 ' H ' ' HB2' ' A' ' 430' ' ' PRO . 15.1 t 55.9 55.56 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.646 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 15.5 m 73.21 130.4 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.536 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -73.94 55.14 0.54 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.995 -174.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 35.0 p -81.01 -55.36 4.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.168 0.508 . . . . 0.0 110.092 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -87.97 -43.47 11.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.855 174.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.1 m 61.21 42.49 12.07 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.88 178.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 70.15 -47.42 0.62 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.603 0.761 . . . . 0.0 112.406 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 115.1 130.84 4.9 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.076 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 68.6 130.15 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.586 0.754 . . . . 0.0 112.14 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -81.34 144.21 31.65 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.493 177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 37.9 m -59.51 -38.16 80.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.927 0.394 . . . . 0.0 110.5 176.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 4.1 m -77.2 113.36 14.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.453 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -138.91 -29.46 0.77 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.835 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.524 ' HG2' ' H ' ' A' ' 468' ' ' ASP . 1.3 pp20? -41.4 133.34 2.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.898 -1.047 . . . . 0.0 113.073 -172.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -78.17 7.65 5.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.869 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.709 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 90.1 m -70.76 -36.18 72.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.024 175.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -52.78 115.35 1.78 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.787 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 122.4 -28.48 5.76 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.587 -176.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.67 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 22.5 mtmm -80.41 138.26 36.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.578 0.227 . . . . 0.0 111.474 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -76.64 -169.79 30.69 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -62.67 -46.04 90.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.95 0.375 . . . . 0.0 111.539 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -64.3 -34.19 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 111.045 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.2 -40.32 27.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.876 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 14.7 t -58.65 114.09 2.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.958 -177.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.837 ' HA ' ' HE3' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -87.51 125.39 34.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.019 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.531 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 m -60.8 -49.03 91.24 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.6 Cg_endo -60.11 -26.74 83.3 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.022 1.815 . . . . 0.0 112.078 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -87.85 -45.34 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.924 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 68.9 m -146.27 152.65 39.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.271 0.558 . . . . 0.0 111.63 -176.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.1 131.84 35.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.3 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -78.71 113.55 16.87 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -74.58 -47.26 33.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.006 0.431 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.71 -46.47 0.18 Allowed Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.226 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -140.07 31.53 2.26 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 177.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.7 t -170.94 145.31 2.32 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.026 0.441 . . . . 0.0 110.242 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.709 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 12.3 t -87.7 132.23 34.19 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.43 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 0.0 OUTLIER -158.29 153.19 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.838 -171.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.524 ' H ' ' HG2' ' A' ' 444' ' ' GLU . 28.2 t70 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.887 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 111.757 -0.537 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 13.5 t -152.07 32.72 0.53 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.529 0.68 . . . . 0.0 109.686 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 423' ' ' LYS . 0.2 OUTLIER 58.08 37.55 26.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.46 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -79.09 -58.28 3.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.99 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.2 m -104.19 -150.56 0.42 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.178 173.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -73.42 106.78 5.37 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 173.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 2.6 p -167.61 130.27 1.63 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.499 -175.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -74.55 -135.58 0.38 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.054 -0.594 . . . . 0.0 113.032 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 9.4 p -156.77 136.83 8.71 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -177.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.454 ' HB3' ' HB ' ' A' ' 434' ' ' THR . 51.9 Cg_exo -54.27 -43.53 57.74 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.564 2.176 . . . . 0.0 111.826 -178.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 8.0 p 43.64 50.86 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.213 1.005 . . . . 0.0 112.588 174.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 2.5 m 60.33 34.67 20.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.729 0.776 . . . . 0.0 110.486 176.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -155.8 46.56 0.48 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.254 -0.885 . . . . 0.0 108.669 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' THR . . . . . 0.454 ' HB ' ' HB3' ' A' ' 430' ' ' PRO . 5.5 t -79.81 67.94 5.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.946 -176.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -63.69 -51.19 66.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.583 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 4.1 m 56.69 43.15 25.83 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.952 0.882 . . . . 0.0 110.522 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -84.62 -42.87 14.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.008 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 75.65 39.49 34.43 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.06 -175.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -152.92 39.01 0.52 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.291 0.567 . . . . 0.0 110.261 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -144.95 50.61 1.25 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.667 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 52.4 m -55.97 -42.89 76.97 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.079 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.406 HG21 ' HG3' ' A' ' 444' ' ' GLU . 22.8 m 71.72 -47.28 0.66 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.341 173.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 61.47 26.68 16.39 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.666 0.746 . . . . 0.0 110.606 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.52 ' HA ' ' HA ' ' A' ' 467' ' ' LYS . 9.6 pt-20 -161.05 43.86 0.17 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.353 173.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -63.25 -27.68 69.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.892 174.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.496 ' SG ' ' HE2' ' A' ' 449' ' ' LYS . 3.6 t -69.9 -8.59 49.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.91 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.428 ' HE2' ' OG1' ' A' ' 465' ' ' THR . 55.0 tttm -59.37 128.82 39.01 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.361 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.05 -34.6 2.51 Favored Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -176.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.593 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 49.2 mtmt -76.63 139.86 40.76 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 177.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -66.95 174.51 25.44 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.85 -0.691 . . . . 0.0 111.45 176.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -58.01 -37.29 74.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.21 -43.48 74.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.383 . . . . 0.0 110.684 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.593 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 3.6 m-20 -72.07 -39.97 68.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.718 -179.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -73.97 71.22 1.55 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.92 176.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.745 ' HG3' ' HD2' ' A' ' 457' ' ' PRO . 20.7 tptm -64.29 135.06 55.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.53 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.543 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 37.2 m -53.72 -51.94 71.95 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -173.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.745 ' HD2' ' HG3' ' A' ' 455' ' ' LYS . 36.2 Cg_exo -61.18 -32.85 91.22 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 121.582 1.521 . . . . 0.0 111.553 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -77.58 -44.7 27.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.727 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 96.9 m -149.71 147.47 28.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 0.0 110.843 -175.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.693 ' HB2' ' HG3' ' A' ' 467' ' ' LYS . 49.4 mmtm -79.19 129.86 34.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.452 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -107.79 125.84 51.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.52 ' HB2' ' NZ ' ' A' ' 467' ' ' LYS . 12.7 tp10 -86.75 -131.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . 0.423 ' H ' ' HG3' ' A' ' 462' ' ' GLU . . . -82.3 -41.11 9.48 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.443 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -159.08 45.4 0.45 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.428 ' OG1' ' HE2' ' A' ' 447' ' ' LYS . 9.6 t -163.4 136.73 5.63 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.547 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 447' ' ' LYS . 11.2 t -90.01 145.86 24.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.959 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.693 ' HG3' ' HB2' ' A' ' 460' ' ' LYS . 9.4 ptpp? -144.88 160.48 41.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.666 0.269 . . . . 0.0 110.391 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.736 -0.65 . . . . 0.0 110.821 -176.977 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.772 0 N-CA-C 111.762 -0.535 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 18.4 m 66.54 73.91 0.35 Allowed 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.246 0.546 . . . . 0.0 110.383 -177.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.632 ' HZ1' ' HB2' ' A' ' 423' ' ' LYS . 4.6 ttmp? -66.75 112.73 4.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.846 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -165.94 -95.35 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.04 178.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 23.2 t -67.2 -41.23 86.16 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -100.68 129.94 46.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.208 176.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 48.8 m -155.62 142.79 19.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.954 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 173.28 -125.78 1.17 Allowed Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 -177.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.416 ' O ' HG21 ' A' ' 429' ' ' VAL . 29.0 m 44.26 107.25 0.01 OUTLIER Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 124.73 1.212 . . . . 0.0 113.59 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.67 52.04 3.19 Favored 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 123.372 2.715 . . . . 0.0 112.063 177.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.545 HG13 ' HB3' ' A' ' 440' ' ' ASP . 2.5 t -95.7 28.87 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.292 0.568 . . . . 0.0 110.164 -178.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 15.4 m -76.71 -47.91 20.46 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.584 177.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -158.51 50.34 0.39 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.138 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 32.3 m -155.18 100.59 2.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.489 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . 0.676 ' HA ' ' HB2' ' A' ' 440' ' ' ASP . 0.4 OUTLIER -128.69 152.94 47.83 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.185 -175.878 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 3.1 m -54.52 -62.96 1.31 Allowed 'General case' 0 CA--C 1.532 0.26 0 O-C-N 123.277 0.36 . . . . 0.0 111.164 -176.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -162.93 31.23 0.1 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.323 0.582 . . . . 0.0 110.383 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 161.3 -40.12 0.41 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.482 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -160.41 131.09 5.48 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . 0.676 ' HB2' ' HA ' ' A' ' 435' ' ' GLN . 38.4 t70 -87.69 -43.0 12.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.281 0.562 . . . . 0.0 110.021 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 7.8 p -82.54 120.17 25.17 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.399 172.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 1.061 HG21 ' HG2' ' A' ' 444' ' ' GLU . 37.8 m -69.65 117.75 11.64 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.93 -175.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -79.36 48.95 0.93 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.087 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 1.061 ' HG2' HG21 ' A' ' 442' ' ' THR . 51.6 mm-40 -58.59 121.44 10.96 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.32 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.4 ' HE2' ' HB3' ' A' ' 445' ' ' LYS . 37.1 ttpt -58.41 -30.7 67.07 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.738 0.78 . . . . 0.0 109.208 173.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.633 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.0 m -79.02 -22.25 45.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.332 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.852 ' HB2' ' HB2' ' A' ' 444' ' ' GLU . 47.3 tptt -53.52 133.01 41.1 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 68.01 33.76 80.01 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.115 -0.948 . . . . 0.0 114.529 171.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.633 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 46.8 mtmt -119.44 147.47 44.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.444 0.622 . . . . 0.0 110.626 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.36 155.48 53.05 Favored Glycine 0 C--O 1.225 -0.409 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.8 -33.99 67.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.297 0.548 . . . . 0.0 111.361 -177.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -57.02 -40.91 77.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.968 0.414 . . . . 0.0 110.535 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.553 ' OD2' ' HD2' ' A' ' 449' ' ' LYS . 33.5 t70 -91.57 -49.18 6.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.061 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.8 OUTLIER -73.21 92.88 1.79 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 111.832 -177.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -152.7 135.04 15.06 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.612 ' C ' ' H ' ' A' ' 458' ' ' ASP . 2.8 t -167.36 149.99 5.69 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.617 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -73.74 26.07 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.395 2.064 . . . . 0.0 109.798 172.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.612 ' H ' ' C ' ' A' ' 456' ' ' SER . 35.2 t70 -151.5 -43.23 0.11 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.569 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.443 ' HB2' ' HB3' ' A' ' 456' ' ' SER . 73.8 m -71.75 138.87 48.77 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.393 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.405 ' HB3' ' NZ ' ' A' ' 460' ' ' LYS . 6.2 ttpm? -113.3 137.42 51.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.861 0.362 . . . . 0.0 110.719 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.756 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 58.7 t-105 -95.84 122.33 38.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.745 177.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.587 ' HG3' ' HE3' ' A' ' 467' ' ' LYS . 48.0 mm-40 -82.4 -38.43 24.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.186 0.517 . . . . 0.0 110.822 -178.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 155.49 -50.31 0.46 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -134.57 29.85 2.95 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 174.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.3 t -175.0 145.18 0.8 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.109 -0.545 . . . . 0.0 109.727 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.756 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 15.8 t -112.76 132.6 55.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.375 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.587 ' HE3' ' HG3' ' A' ' 462' ' ' GLU . 22.4 pttp -178.12 142.67 0.28 Allowed 'General case' 0 C--O 1.233 0.209 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 40.2 t0 . . . . . 0 C--O 1.253 1.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.914 175.94 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.746 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 10.0 t -155.17 136.9 14.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.888 0.375 . . . . 0.0 109.997 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -73.33 130.85 41.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.635 -177.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . 0.646 ' HB1' ' HB2' ' A' ' 427' ' ' SER . . . -83.52 161.6 21.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.143 175.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 7.5 p -74.86 36.61 0.11 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . 0.417 ' H ' ' C ' ' A' ' 424' ' ' ALA . 25.1 ttpp 178.71 -47.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 176.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 427' ' ' SER . . . . . 0.646 ' HB2' ' HB1' ' A' ' 424' ' ' ALA . 20.1 m -59.68 138.34 57.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.324 -177.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 125.86 -53.68 0.77 Allowed Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.351 -1.1 . . . . 0.0 110.351 -174.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 35.6 t 56.37 99.58 0.04 OUTLIER Pre-proline 0 C--O 1.235 0.33 0 C-N-CA 123.234 0.614 . . . . 0.0 112.216 173.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -68.53 122.52 9.5 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.338 2.025 . . . . 0.0 110.057 174.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.07 111.24 5.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.004 0.43 . . . . 0.0 110.098 -176.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 27.6 m -85.76 -45.62 11.45 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.17 -175.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.456 ' C ' ' HG1' ' A' ' 434' ' ' THR . 95.3 mm-40 -69.18 -52.67 25.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.889 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' THR . . . . . 0.456 ' HG1' ' C ' ' A' ' 433' ' ' GLN . 1.9 p 50.13 62.68 2.54 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.091 0.472 . . . . 0.0 110.635 -175.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 64.12 -131.85 0.36 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.303 -175.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 4.7 p -69.47 94.91 0.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.887 0.375 . . . . 0.0 111.231 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.8 137.75 44.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.041 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 62.83 -123.68 30.93 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.475 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -156.58 -136.62 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 2.8 p30 43.81 34.99 0.97 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.038 0.935 . . . . 0.0 112.899 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 15.2 t -90.73 129.35 36.83 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.056 0.455 . . . . 0.0 110.12 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 10.3 t -170.01 -151.92 0.09 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.27 -176.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -67.27 -53.86 26.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.754 0.312 . . . . 0.0 110.673 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -168.12 47.5 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.932 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.446 ' HG3' ' HB3' ' A' ' 468' ' ' ASP . 0.0 OUTLIER 66.42 30.48 8.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.653 177.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.582 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 85.2 m 63.48 20.99 12.55 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.324 175.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.489 ' NZ ' ' HB2' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -78.73 134.73 37.04 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.808 -177.225 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.7 32.82 35.98 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.509 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -113.51 143.12 45.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.45 163.76 52.91 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.604 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.63 -40.38 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.151 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 12.5 mptt -74.39 -34.6 63.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -71.61 -45.48 61.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 0.0 110.03 177.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.467 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.1 t -60.45 133.08 55.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.179 176.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -128.7 134.4 48.47 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.564 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 8.7 m -54.37 -50.74 83.3 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -173.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.564 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 31.9 Cg_exo -59.02 -28.22 87.25 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.824 1.683 . . . . 0.0 111.267 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -81.22 -54.58 5.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.548 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 95.1 m -155.8 158.88 38.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.101 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -89.37 137.67 32.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.939 0.4 . . . . 0.0 111.459 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.467 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 66.3 t-105 -89.25 117.99 28.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.66 174.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.497 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 6.0 mm-40 -119.05 116.62 26.78 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.958 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 66.15 -66.75 0.14 Allowed Glycine 0 C--N 1.333 0.385 0 O-C-N 123.807 0.692 . . . . 0.0 113.476 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -170.36 38.58 0.19 Allowed Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.5 t -159.8 139.98 11.79 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -178.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.582 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.7 t -94.82 139.03 31.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -174.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.497 ' HD3' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -155.55 151.87 28.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.34 . . . . 0.0 111.147 -177.568 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.446 ' HB3' ' HG3' ' A' ' 445' ' ' LYS . 10.1 p-10 . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.781 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.96 0 N-CA-C 112.405 -0.278 . . . . 0.0 112.405 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 14.4 t -148.78 -174.24 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp 72.07 142.16 0.06 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.632 0.583 . . . . 0.0 111.015 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -57.58 140.62 50.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.251 -178.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 24.3 m -59.48 129.13 40.49 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.805 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -175.5 -46.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.59 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 15.0 m -65.88 -35.61 81.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.373 -178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 83.35 -127.77 8.19 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.347 -175.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 6.1 p -151.59 126.09 4.57 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-O 120.907 0.384 . . . . 0.0 110.545 178.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.66 -39.65 20.21 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.537 2.158 . . . . 0.0 111.452 -178.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.59 131.2 33.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.945 176.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 6.1 m -60.31 124.14 19.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.603 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -156.72 -57.41 0.09 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.257 -177.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 1.7 p -85.0 -69.11 0.67 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.756 -175.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 88.4 mm-40 67.13 -63.47 0.28 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.644 0.778 . . . . 0.0 111.966 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 71.1 p 51.02 -139.36 0.95 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.508 0.723 . . . . 0.0 111.096 -178.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 64.4 157.86 0.09 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.29 0.567 . . . . 0.0 112.164 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 179.81 135.28 2.4 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.65 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -105.26 46.45 0.92 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 35.5 t70 72.38 120.19 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.529 -177.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 11.6 m -75.01 -57.07 4.13 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.14 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.2 m -162.95 114.93 1.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.115 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -77.83 127.61 32.68 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.411 ' HA ' ' HB3' ' A' ' 447' ' ' LYS . 35.1 mt-10 -78.42 67.69 4.26 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.075 0.464 . . . . 0.0 111.415 -176.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -69.14 -15.29 63.38 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.972 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.58 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 24.9 p -166.86 -31.59 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.932 -174.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.677 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 60.2 tttm -43.75 120.0 1.87 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.826 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.99 -32.83 5.31 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -61.58 152.81 29.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.009 0.433 . . . . 0.0 111.809 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.48 166.52 54.61 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.045 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -55.3 -50.76 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 26.5 tttm -63.85 -43.0 97.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.835 0.35 . . . . 0.0 110.801 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -67.19 -42.91 83.41 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.709 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.429 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 12.1 t -60.45 105.68 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.2 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 454' ' ' CYS . 38.7 mmtm -165.38 43.58 0.08 Allowed 'General case' 0 CA--C 1.498 -1.032 0 CA-C-O 121.854 0.835 . . . . 0.0 108.928 176.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.71 ' HB2' ' CB ' ' A' ' 459' ' ' CYS . 50.3 m -72.19 135.12 82.41 Favored Pre-proline 0 C--N 1.296 -1.737 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.935 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.75 24.44 0.29 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.559 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.703 ' H ' ' C ' ' A' ' 456' ' ' SER . 46.0 t0 -148.69 -27.86 0.3 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 112.818 -1.992 . . . . 0.0 108.84 -176.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.71 ' CB ' ' HB2' ' A' ' 456' ' ' SER . 13.7 t -88.49 -174.77 4.72 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.039 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.427 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 5.4 mmmm -158.41 135.02 9.55 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.356 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.429 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 56.3 t-105 -85.79 122.21 29.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.449 ' O ' HG21 ' A' ' 465' ' ' THR . 71.4 tt0 -156.68 130.01 8.05 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.894 -178.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.99 36.76 92.45 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.298 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.62 82.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.604 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.449 HG21 ' O ' ' A' ' 462' ' ' GLU . 15.0 t -157.9 142.45 16.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.357 0.598 . . . . 0.0 110.945 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.677 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 5.5 t -79.32 142.1 36.4 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.1 pttp 178.07 137.87 0.08 Allowed 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.048 0.451 . . . . 0.0 111.217 -177.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 54.1 t0 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.506 -0.759 . . . . 0.0 109.446 174.926 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.874 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.52 129.68 38.49 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.932 0.366 . . . . 0.0 111.242 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 52.6 tttm 71.26 -54.16 0.67 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.164 0.986 . . . . 0.0 112.375 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -87.25 -163.56 0.94 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.575 0.226 . . . . 0.0 111.257 -178.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 6.5 t 59.48 37.24 23.04 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.721 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -93.81 142.47 27.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.479 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.2 t -162.6 41.17 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.593 0.711 . . . . 0.0 109.21 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 165.81 147.63 5.24 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.869 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 67.1 t 69.89 112.38 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.453 0 CA-C-O 121.277 0.56 . . . . 0.0 111.221 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -82.17 44.8 1.78 Allowed 'Trans proline' 0 CA--C 1.53 0.286 0 C-N-CA 123.007 2.471 . . . . 0.0 113.663 -176.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 3.1 m -75.97 129.83 36.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.786 0.326 . . . . 0.0 110.927 177.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' THR . . . . . 0.427 ' O ' ' HB2' ' A' ' 433' ' ' GLN . 7.0 t 177.67 -31.0 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.438 -178.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.427 ' HB2' ' O ' ' A' ' 432' ' ' THR . 68.8 mt-30 73.74 -58.19 0.6 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.705 0.802 . . . . 0.0 111.327 -178.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.6 t -83.06 60.06 5.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 122.04 0.924 . . . . 0.0 110.36 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -62.48 -49.97 73.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.186 -0.916 . . . . 0.0 111.426 -176.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' THR . . . . . 0.5 ' HB ' ' HB2' ' A' ' 439' ' ' ALA . 11.5 p -71.17 -51.87 22.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.249 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 69.66 -53.61 0.61 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.655 0.782 . . . . 0.0 111.935 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -99.49 40.84 2.33 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.978 -0.63 . . . . 0.0 112.044 177.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . 0.5 ' HB2' ' HB ' ' A' ' 436' ' ' THR . . . -171.41 123.49 0.56 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 110.146 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -72.55 -34.3 67.43 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.759 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 22.1 p 50.86 46.69 25.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.585 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.5 m -81.95 -35.9 28.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.899 174.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 57.1 -116.9 1.0 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.528 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -118.06 43.13 2.51 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.074 0.464 . . . . 0.0 110.863 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -72.53 -34.21 67.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.359 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 79.3 m -76.07 -42.7 46.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.093 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -58.9 126.46 27.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.427 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 120.44 -31.44 5.24 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.597 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -70.09 139.48 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.751 0.31 . . . . 0.0 111.329 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.37 165.34 54.32 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.42 -48.36 71.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.179 0.489 . . . . 0.0 111.692 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -67.56 -34.47 77.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.033 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -74.0 -44.32 54.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.853 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.0 t -54.99 119.26 5.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.124 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -90.38 123.64 34.28 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.491 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 28.2 t -57.19 -49.3 94.7 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 39.7 Cg_exo -60.57 -29.94 89.58 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 121.854 1.702 . . . . 0.0 111.786 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -82.32 -49.12 10.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.116 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.433 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 20.2 m -140.81 135.95 31.94 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -80.08 122.57 26.94 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.979 0.418 . . . . 0.0 110.484 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.461 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 68.6 t-105 -84.3 126.37 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.437 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 8.9 tt0 -156.97 133.3 9.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.604 0.24 . . . . 0.0 110.734 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.25 34.53 89.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.514 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.18 37.68 95.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.818 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 13.3 t -155.87 141.81 18.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.429 . . . . 0.0 110.314 177.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.461 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 30.9 t -89.05 126.52 35.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.812 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.437 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 63.5 pttt -144.25 139.85 28.9 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.805 0.336 . . . . 0.0 110.473 -178.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.417 ' HB3' ' SG ' ' A' ' 446' ' ' CYS . 3.3 p30 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.636 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.707 0 N-CA-C 111.844 -0.503 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.3 m -77.34 59.92 1.92 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.567 0.698 . . . . 0.0 111.529 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -122.35 34.65 5.09 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.923 178.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -168.75 48.53 0.04 OUTLIER 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.343 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 44.1 m -59.51 130.11 45.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.234 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . 0.441 ' C ' ' HG ' ' A' ' 427' ' ' SER . 36.2 mtmm -66.68 -51.22 58.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.3 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 427' ' ' SER . . . . . 0.441 ' HG ' ' C ' ' A' ' 426' ' ' LYS . 35.8 p 47.32 39.23 8.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.804 178.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -87.61 -45.28 5.26 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.625 178.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.414 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 3.4 p -162.71 123.64 1.52 Allowed Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 22.9 Cg_exo -68.65 128.69 17.46 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.66 2.24 . . . . 0.0 112.481 -175.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 33.4 m -85.91 -4.83 9.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.708 0.766 . . . . 0.0 110.373 176.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.2 p -72.22 135.99 46.24 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 114.701 -1.136 . . . . 0.0 111.214 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -62.52 131.98 50.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.97 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 31.5 m -58.7 -46.75 86.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.637 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -166.1 126.57 1.73 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.753 174.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 10.2 t -65.24 125.46 25.11 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.027 0.442 . . . . 0.0 110.473 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -169.15 142.73 2.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.98 -176.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 79.73 41.71 12.41 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.505 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -67.42 -34.4 77.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.789 0.328 . . . . 0.0 110.552 177.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 38.7 t70 62.16 52.24 3.28 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.042 -178.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 35.6 m -155.09 120.78 5.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.427 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 32.5 m -78.75 119.71 22.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.328 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -75.57 -27.18 58.48 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.884 178.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.47 ' C ' ' H ' ' A' ' 446' ' ' CYS . 6.2 tp10 -45.6 125.64 6.07 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.647 -173.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.421 ' O ' ' HE2' ' A' ' 449' ' ' LYS . 15.3 ttmm -74.16 42.4 0.15 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.522 -178.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.47 ' H ' ' C ' ' A' ' 444' ' ' GLU . 58.1 m -145.58 5.42 1.05 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.739 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -78.01 106.81 10.13 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.302 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 59.07 47.39 91.03 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.326 -0.852 . . . . 0.0 114.067 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.803 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 26.9 mtmt -107.55 -169.38 1.52 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.296 0.548 . . . . 0.0 110.25 174.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.44 154.1 36.08 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.29 -35.58 75.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.925 0.363 . . . . 0.0 110.453 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -57.77 -48.37 79.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.412 177.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.611 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.4 OUTLIER -68.92 -54.58 14.66 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.093 176.529 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.803 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 27.6 m -70.98 96.15 1.26 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.014 -0.994 . . . . 0.0 112.826 -174.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -145.9 142.51 28.83 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.561 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.593 ' C ' ' H ' ' A' ' 458' ' ' ASP . 3.3 t 174.71 149.26 0.25 Allowed Pre-proline 0 C--N 1.317 -0.814 0 O-C-N 124.138 0.899 . . . . 0.0 109.113 -178.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.76 27.88 0.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.268 1.979 . . . . 0.0 109.945 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.593 ' H ' ' C ' ' A' ' 456' ' ' SER . 11.6 t70 -150.58 -43.36 0.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.961 -177.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.484 ' SG ' ' HB3' ' A' ' 456' ' ' SER . 62.1 m -68.56 134.32 49.84 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 174.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -125.34 149.76 47.81 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.848 -175.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.512 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 29.7 t-105 -101.49 131.03 47.84 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.667 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.574 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 40.0 tp10 -158.73 122.08 3.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.821 0.343 . . . . 0.0 110.905 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.37 41.55 98.07 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.52 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.1 41.85 99.67 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.12 -0.562 . . . . 0.0 112.764 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -169.97 147.86 3.36 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.06 0.457 . . . . 0.0 110.451 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.512 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.6 OUTLIER -95.27 145.42 25.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.255 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.574 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 62.3 pttt -157.25 149.05 22.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.049 0.452 . . . . 0.0 111.933 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 59.9 t0 . . . . . 0 C--O 1.248 1.009 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.103 174.723 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.625 0 N-CA-C 112.083 -0.407 . . . . 0.0 112.083 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 3.4 m 59.28 48.95 9.57 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.196 0.522 . . . . 0.0 110.828 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.702 ' HA ' ' HA2' ' A' ' 428' ' ' GLY . 0.0 OUTLIER -165.38 145.02 6.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.734 176.702 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -151.65 -63.53 0.18 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.008 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 31.1 t -170.09 -55.48 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -80.61 -43.4 20.59 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -173.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.8 t -171.59 69.52 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.989 0.423 . . . . 0.0 111.112 -176.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . 0.702 ' HA2' ' HA ' ' A' ' 423' ' ' LYS . . . 66.93 -127.49 27.85 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.215 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.624 HG21 ' H ' ' A' ' 431' ' ' VAL . 5.1 p -64.83 124.04 85.3 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-O 120.927 0.394 . . . . 0.0 110.036 176.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.619 ' O ' HG22 ' A' ' 431' ' ' VAL . 72.7 Cg_endo -79.66 1.43 9.22 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.61 2.207 . . . . 0.0 112.694 -176.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.624 ' H ' HG21 ' A' ' 429' ' ' VAL . 32.7 m 43.51 42.34 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.234 1.014 . . . . 0.0 112.097 -178.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 5.6 m -66.53 136.53 55.79 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.291 -178.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -151.06 -41.42 0.12 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.692 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 5.2 p -81.16 37.73 0.45 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.821 0.343 . . . . 0.0 111.754 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -139.71 90.39 2.39 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 175.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 5.1 m -136.71 140.9 42.98 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.47 -175.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 64.47 45.59 3.64 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 123.659 0.6 . . . . 0.0 111.478 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 64.13 49.24 68.04 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.865 177.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -69.41 132.37 46.24 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 178.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -63.84 115.32 4.72 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.832 0.349 . . . . 0.0 110.753 -178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.466 ' C ' ' HG1' ' A' ' 442' ' ' THR . 7.0 p -77.74 123.76 27.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.775 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.634 ' HA ' ' HB3' ' A' ' 468' ' ' ASP . 14.6 m -160.87 -51.75 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.427 178.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 56.14 35.71 26.14 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.025 0.44 . . . . 0.0 111.167 -178.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 51.79 35.49 15.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.729 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 442' ' ' THR . 0.0 OUTLIER -77.26 -33.18 55.95 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.467 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 67.5 m -148.79 18.8 1.01 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.781 -179.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.556 ' HB2' HG22 ' A' ' 442' ' ' THR . 58.0 tptt -71.32 118.33 13.99 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.535 178.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.76 23.97 61.12 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.499 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.467 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 23.1 ttmm -90.41 138.4 31.57 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -71.19 164.62 53.7 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.741 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.13 -37.91 78.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 117.013 0.406 . . . . 0.0 111.783 -177.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -74.66 -39.61 61.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.825 0.345 . . . . 0.0 110.599 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -70.05 -40.69 74.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.797 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.529 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.0 t -61.53 125.97 25.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.624 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.415 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 7.8 ptpp? -124.79 132.28 53.36 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.333 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.508 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.5 m -52.83 -47.95 93.05 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -59.51 -25.93 80.35 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.718 1.612 . . . . 0.0 111.94 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.415 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 26.0 t70 -92.99 -46.56 7.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.52 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.487 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 85.4 m -147.23 156.34 42.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 110.83 -178.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -90.03 120.27 31.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.64 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.529 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 70.6 t-105 -81.69 117.56 22.12 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -84.03 -37.65 21.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.02 0.438 . . . . 0.0 110.499 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 166.74 -46.03 0.26 Allowed Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.342 -0.703 . . . . 0.0 111.342 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -131.67 -10.3 2.36 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 11.2 m -130.26 136.03 48.74 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.967 0.413 . . . . 0.0 110.7 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 18.2 t -92.46 119.86 32.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.437 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.27 133.21 49.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.052 -175.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.634 ' HB3' ' HA ' ' A' ' 442' ' ' THR . 35.2 t70 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.576 -0.726 . . . . 0.0 110.869 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 3.6 m -69.17 -35.34 76.18 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.318 0.58 . . . . 0.0 110.414 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -111.93 49.12 0.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.062 176.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -161.16 136.54 7.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.434 -178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.6 t -173.34 -133.59 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -44.52 88.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 29.0 t -77.99 146.48 35.39 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.248 175.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -149.91 -61.72 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 177.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 56.8 t -100.95 111.34 63.16 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 170.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -71.44 120.05 6.68 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.326 2.017 . . . . 0.0 112.167 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 35.8 m -84.94 35.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.386 0.612 . . . . 0.0 110.791 177.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 19.7 m -65.5 137.82 57.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.514 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -73.3 58.55 0.54 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.196 0.522 . . . . 0.0 110.576 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 20.0 m -160.56 -46.78 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.487 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -84.66 44.14 1.03 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.938 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.4 m -114.83 40.28 2.65 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.489 0.662 . . . . 0.0 109.996 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -74.65 143.24 44.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.162 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -87.12 47.39 3.67 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.043 -0.599 . . . . 0.0 111.937 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -85.05 57.06 4.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.737 0.303 . . . . 0.0 111.319 -177.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 44.0 t0 60.67 40.88 15.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.437 0.637 . . . . 0.0 110.441 -178.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 36.2 m -72.59 -39.74 67.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.393 176.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 444' ' ' GLU . 7.4 m -151.45 158.28 43.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.335 177.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . 0.401 ' H ' HG22 ' A' ' 442' ' ' THR . . . -61.09 -28.97 69.47 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.905 0.383 . . . . 0.0 110.335 177.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.61 ' HA ' ' OD1' ' A' ' 468' ' ' ASP . 78.6 mt-10 68.28 62.09 0.38 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.884 176.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.39 -29.1 24.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.49 -0.777 . . . . 0.0 108.918 172.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.437 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 76.7 m -79.48 -34.84 41.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.791 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.432 ' HZ1' ' CD ' ' A' ' 444' ' ' GLU . 5.1 tppp? -48.38 122.34 5.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.924 -174.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 61.35 33.51 84.82 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.411 -0.813 . . . . 0.0 113.907 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.76 ' HD3' ' HA ' ' A' ' 454' ' ' CYS . 18.2 ptmt -85.31 -19.94 30.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.174 0.487 . . . . 0.0 110.954 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 103.65 150.78 21.88 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.806 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . 0.416 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 29.1 tt0 -63.37 -43.1 98.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 122.455 0.302 . . . . 0.0 111.44 -175.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.52 42.04 0.81 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.365 0.603 . . . . 0.0 110.563 177.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -160.62 -38.14 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.445 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.76 ' HA ' ' HD3' ' A' ' 449' ' ' LYS . 19.9 t -74.49 73.98 1.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.09 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.5 132.83 47.65 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.467 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.3 m -50.19 -50.31 70.77 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -171.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 456' ' ' SER . 20.2 Cg_endo -61.6 -31.61 87.07 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.839 1.693 . . . . 0.0 111.688 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -83.29 -44.1 15.29 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.4 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.21 146.3 26.75 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -86.26 128.34 34.9 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.706 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.599 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 64.8 t-105 -96.13 111.15 23.27 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 174.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -82.88 47.11 1.16 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.978 0.418 . . . . 0.0 110.971 -176.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 57.95 38.13 87.78 Favored Glycine 0 C--N 1.33 0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.688 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 152.47 -37.48 0.79 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.179 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 24.4 m -123.16 129.16 51.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.201 . . . . 0.0 111.218 -177.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.599 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 23.2 t -82.01 138.06 34.97 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.33 141.43 32.36 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.01 0.433 . . . . 0.0 110.754 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.61 ' OD1' ' HA ' ' A' ' 444' ' ' GLU . 1.8 m-20 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.994 -178.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.633 0 N-CA-C 111.737 -0.545 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.4 t -66.0 141.98 57.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.869 0.366 . . . . 0.0 110.345 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -154.41 46.87 0.58 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.768 0.794 . . . . 0.0 109.32 -177.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -73.76 125.81 28.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.693 -178.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 56.3 m -75.74 120.63 21.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.752 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -72.72 -37.5 67.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.248 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 49.4 m 66.97 123.86 0.02 OUTLIER 'General case' 0 C--O 1.235 0.322 0 O-C-N 124.072 0.857 . . . . 0.0 111.731 177.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 179.55 124.16 0.87 Allowed Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.233 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 35.4 m -73.46 135.8 78.58 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-O 120.795 0.331 . . . . 0.0 110.823 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -71.14 142.68 42.46 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.823 2.349 . . . . 0.0 111.861 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 14.2 p -166.65 139.02 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.259 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 20.3 m -65.78 -44.6 85.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.911 -176.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -123.65 122.94 39.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.85 174.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 12.6 t -74.03 139.73 44.93 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 70.63 123.65 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.019 -175.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 20.7 m -95.45 116.14 28.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.969 175.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -161.41 129.89 4.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.281 -178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 176.67 145.6 5.72 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.561 -0.616 . . . . 0.0 111.561 -178.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -62.64 -41.44 99.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.779 0.323 . . . . 0.0 110.678 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 4.6 t70 59.54 47.3 11.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.184 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 17.5 p -65.81 -40.84 92.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.193 -177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.419 ' C ' ' H ' ' A' ' 444' ' ' GLU . 9.7 t -170.26 147.74 3.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.401 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -80.0 41.09 0.49 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.309 175.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.76 ' HB3' ' HB2' ' A' ' 447' ' ' LYS . 17.8 mm-40 59.37 67.36 0.91 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.856 -175.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -55.61 -35.11 65.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.933 172.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 2.9 m -77.62 -59.95 2.57 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.059 -178.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.76 ' HB2' ' HB3' ' A' ' 444' ' ' GLU . 81.1 tttt 33.07 75.67 0.05 OUTLIER 'General case' 0 C--O 1.235 0.294 0 N-CA-C 114.379 1.252 . . . . 0.0 114.379 176.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.676 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . 48.66 35.1 15.93 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 114.562 -1.199 . . . . 0.0 115.37 169.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.689 ' HG3' ' HB2' ' A' ' 454' ' ' CYS . 0.3 OUTLIER -85.81 149.45 25.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.921 0.86 . . . . 0.0 108.84 173.111 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -56.04 150.97 22.61 Favored Glycine 0 C--O 1.227 -0.318 0 C-N-CA 121.444 -0.408 . . . . 0.0 113.384 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.6 -33.48 66.27 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.79 -176.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.412 ' HA ' ' HD3' ' A' ' 452' ' ' LYS . 27.3 mmtp -61.66 -37.93 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.87 0.367 . . . . 0.0 110.204 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -81.06 -48.04 12.74 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.781 175.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.689 ' HB2' ' HG3' ' A' ' 449' ' ' LYS . 0.5 OUTLIER -84.58 116.71 23.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.519 -173.715 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -89.43 139.81 30.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.837 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.53 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 10.5 t -58.78 -48.79 96.17 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.994 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.3 Cg_endo -58.51 -29.85 89.99 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.853 1.702 . . . . 0.0 112.007 178.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -84.05 -42.32 16.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 67.7 m -141.58 149.82 41.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.372 -173.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -79.37 135.69 36.78 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.998 0.428 . . . . 0.0 110.532 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 52.3 t-105 -106.28 132.35 52.44 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.855 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.416 ' OE2' ' HD2' ' A' ' 467' ' ' LYS . 30.2 mt-10 -129.64 79.94 1.93 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.856 0.36 . . . . 0.0 111.402 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.29 -63.11 2.96 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.363 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.1 36.49 0.53 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.833 -0.698 . . . . 0.0 111.786 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.0 t -157.87 141.94 15.91 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.676 ' H ' ' HA2' ' A' ' 448' ' ' GLY . 0.5 OUTLIER -104.7 145.93 29.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.879 -178.22 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.455 ' HA ' ' OE1' ' A' ' 444' ' ' GLU . 18.5 ptpt -163.52 159.46 22.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.987 0.422 . . . . 0.0 111.764 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.2 t0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.967 176.427 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.677 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.14 139.13 52.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.894 0.378 . . . . 0.0 111.526 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -161.06 130.93 4.92 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -68.31 -48.78 64.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.855 -174.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 8.3 t -156.69 -136.8 0.05 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -178.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . 0.433 ' C ' ' HG ' ' A' ' 427' ' ' SER . 35.4 mmtp 57.42 37.48 27.91 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.109 0.481 . . . . 0.0 111.226 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 427' ' ' SER . . . . . 0.433 ' HG ' ' C ' ' A' ' 426' ' ' LYS . 26.2 m -162.24 -46.75 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -163.5 -128.93 0.99 Allowed Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.461 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 4.6 p -156.41 120.73 2.37 Favored Pre-proline 0 C--N 1.317 -0.828 0 O-C-N 122.446 -0.443 . . . . 0.0 110.374 175.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 24.0 Cg_exo -64.58 99.99 0.32 Allowed 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.669 2.246 . . . . 0.0 111.239 -178.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.64 111.14 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.826 -176.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.8 m 60.49 25.28 14.89 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.832 -175.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 65.11 -62.95 0.2 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.879 0.872 . . . . 0.0 111.875 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 13.1 m -80.99 122.66 27.55 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 177.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -74.19 138.61 43.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.787 0.327 . . . . 0.0 110.863 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 8.8 t -165.59 136.29 3.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.786 178.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 61.0 40.79 14.85 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.372 -176.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -171.86 42.15 0.18 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.641 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -84.14 -39.48 19.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.472 177.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -72.98 136.27 45.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.184 179.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 2.1 m -77.48 50.42 0.8 Allowed 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.965 -174.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 7.4 t -97.72 -24.91 15.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.526 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 61.17 26.8 16.64 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.435 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.497 ' HG2' ' HB3' ' A' ' 447' ' ' LYS . 10.2 tt0 49.34 40.97 19.67 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.364 176.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -80.48 -24.43 39.48 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.769 -179.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 83.5 m -73.94 -35.46 64.57 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.372 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.497 ' HB3' ' HG2' ' A' ' 444' ' ' GLU . 65.1 tttp -64.74 117.73 7.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 139.25 -35.97 1.91 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -175.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.78 137.75 54.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.131 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.76 -169.99 41.94 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 169.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -67.11 -34.89 78.58 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 117.108 0.454 . . . . 0.0 111.234 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.67 -38.92 53.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.118 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.44 -49.07 67.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.511 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 4.7 t -62.4 123.46 18.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.347 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 51.5 mttm -141.91 33.28 1.58 Allowed 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 122.023 0.916 . . . . 0.0 110.114 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.672 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 39.0 m 45.67 50.12 7.41 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 113.059 -1.882 . . . . 0.0 113.136 178.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.556 ' HD3' ' N ' ' A' ' 456' ' ' SER . 5.2 Cg_exo -74.33 -44.75 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.902 1.735 . . . . 0.0 109.88 175.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.01 36.81 0.15 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 173.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.672 ' O ' ' HA ' ' A' ' 456' ' ' SER . 57.4 m -147.89 145.42 28.65 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.756 -171.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -114.41 136.47 52.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.747 0.308 . . . . 0.0 110.616 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 58.8 t-105 -80.94 118.63 22.59 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.769 ' HB3' ' HD2' ' A' ' 467' ' ' LYS . 34.2 tt0 -155.06 133.09 11.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.657 0.265 . . . . 0.0 110.724 -175.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.39 35.94 81.5 Favored Glycine 0 C--O 1.234 0.122 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.794 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 62.17 40.1 98.52 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.417 HG22 ' CG ' ' A' ' 467' ' ' LYS . 5.3 m -157.76 133.77 9.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.804 0.335 . . . . 0.0 110.529 -175.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . . . . . . . . . 11.9 t -86.62 119.41 26.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.769 ' HD2' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -157.85 155.12 29.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.752 -173.291 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.267 -0.873 . . . . 0.0 111.197 -176.493 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 7.0 m -65.42 -45.56 83.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.743 0.306 . . . . 0.0 110.374 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 39.2 tptt 69.82 -66.64 0.26 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.275 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . 0.586 ' HA ' HG23 ' A' ' 434' ' ' THR . . . -95.94 118.94 33.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.638 0.256 . . . . 0.0 110.437 176.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 4.0 m -75.19 -40.68 59.16 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.397 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 44.9 tptt 58.08 40.03 25.63 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.037 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.15 -36.63 40.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.592 178.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -173.9 -118.85 0.52 Allowed Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 110.701 -0.959 . . . . 0.0 110.701 -178.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 58.0 t -76.27 127.83 83.98 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -59.64 112.26 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.366 2.044 . . . . 0.0 112.126 -177.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.446 ' C ' ' HG1' ' A' ' 432' ' ' THR . 2.9 t -90.88 44.95 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.614 -177.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 432' ' ' THR . . . . . 0.446 ' HG1' ' C ' ' A' ' 431' ' ' VAL . 19.5 p 49.44 38.43 14.26 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.28 0.632 . . . . 0.0 111.891 -178.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.56 -23.62 15.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.562 179.115 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 434' ' ' THR . . . . . 0.586 HG23 ' HA ' ' A' ' 424' ' ' ALA . 4.7 p -63.11 -57.7 9.71 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.685 -179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 51.18 49.22 21.54 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.41 175.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 13.2 t -82.2 143.45 31.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.671 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -155.3 -47.21 0.08 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.763 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . 0.585 ' HA3' ' HB3' ' A' ' 443' ' ' ALA . . . -89.51 -38.75 6.52 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.336 178.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 70.76 -53.08 0.67 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.723 0.809 . . . . 0.0 112.38 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -69.79 128.48 36.54 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 54.2 m 70.03 -65.92 0.29 Allowed 'General case' 0 C--N 1.331 -0.231 0 O-C-N 123.907 0.754 . . . . 0.0 111.273 -179.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.429 ' CG2' ' HB2' ' A' ' 445' ' ' LYS . 12.3 t 176.54 -32.95 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.876 174.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . 0.585 ' HB3' ' HA3' ' A' ' 438' ' ' GLY . . . 70.12 -56.84 0.58 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.723 0.809 . . . . 0.0 111.706 -179.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.564 ' HG3' ' HD2' ' A' ' 447' ' ' LYS . 9.5 mp0 -78.63 37.64 0.29 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.909 0.385 . . . . 0.0 111.455 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.46 ' HD2' ' SG ' ' A' ' 459' ' ' CYS . 24.2 ttmt -73.48 -33.14 64.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.53 0.681 . . . . 0.0 109.578 174.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 65.1 m -132.64 1.82 3.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.301 -173.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.564 ' HD2' ' HG3' ' A' ' 444' ' ' GLU . 37.1 ttmt -62.64 120.83 11.94 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.277 -177.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 115.31 -17.43 16.67 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.292 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.62 ' HB3' ' HB3' ' A' ' 453' ' ' ASP . 42.6 mtmt -81.74 142.3 32.77 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.857 0.328 . . . . 0.0 110.825 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.61 167.15 50.74 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -56.95 -38.55 73.09 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -69.54 -31.09 69.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.774 0.321 . . . . 0.0 111.263 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.62 ' HB3' ' HB3' ' A' ' 449' ' ' LYS . 2.3 t0 -81.57 -38.67 25.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.0 109.519 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -60.61 145.73 47.89 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.559 174.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.479 ' HD2' ' O ' ' A' ' 453' ' ' ASP . 7.8 mptt -137.29 148.78 46.63 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.493 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 3.5 m -63.41 -47.51 83.73 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 456' ' ' SER . 37.7 Cg_endo -65.25 -29.38 55.2 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 121.029 1.152 . . . . 0.0 110.965 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.54 -48.36 22.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.41 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.46 ' SG ' ' HD2' ' A' ' 445' ' ' LYS . 36.4 m -158.06 -162.17 1.11 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.175 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -121.65 136.92 54.93 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.313 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.457 ' CE3' ' HB2' ' A' ' 466' ' ' CYS . 71.9 t-105 -103.18 124.75 49.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.6 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -135.5 110.88 9.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.761 0.315 . . . . 0.0 110.781 -178.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 70.09 -67.02 0.68 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.668 -0.696 . . . . 0.0 113.034 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -169.44 43.08 0.21 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -157.78 138.22 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.938 0.399 . . . . 0.0 110.032 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.457 ' HB2' ' CE3' ' A' ' 461' ' ' TRP . 14.7 t -106.86 130.51 54.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.212 -176.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -161.49 150.68 16.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.168 0.508 . . . . 0.0 112.025 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 37.3 t0 . . . . . 0 C--O 1.245 0.859 0 CA-C-O 118.07 -0.967 . . . . 0.0 109.382 179.595 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.876 0 N-CA-C 112.203 -0.359 . . . . 0.0 112.203 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 15.4 t -179.96 143.8 0.18 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt 62.46 37.88 13.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.26 0.553 . . . . 0.0 110.242 -177.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -90.2 141.89 28.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.637 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.9 t -77.08 93.06 3.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -78.64 49.94 0.93 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.076 -177.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 22.8 t -94.23 126.18 39.32 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.499 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 158.29 -51.28 0.4 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.446 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 7.5 p -163.95 125.87 1.55 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-O 121.207 0.527 . . . . 0.0 111.031 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 16.5 Cg_exo -67.37 131.15 24.07 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.666 2.244 . . . . 0.0 110.846 178.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 4.4 t -84.51 46.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.411 0.624 . . . . 0.0 109.7 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 3.2 p -86.89 128.54 35.06 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.831 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -97.19 130.56 44.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.394 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.1 t -78.59 -39.7 36.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.69 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -171.75 143.39 1.67 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.685 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 1.9 p -70.15 81.78 0.52 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.338 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 60.67 -143.87 0.5 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.392 -175.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -167.32 130.36 2.1 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.209 179.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -172.42 127.59 0.54 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -82.57 54.17 2.56 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.905 0.383 . . . . 0.0 110.094 178.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.0 t -65.79 135.1 54.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.905 -177.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 8.9 t -156.34 -19.87 0.1 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.232 -176.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 60.83 -153.16 0.38 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.435 -178.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 444' ' ' GLU . 33.0 tt0 -91.84 39.5 1.01 Allowed 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.538 0.685 . . . . 0.0 110.654 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -71.02 -37.97 72.61 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 172.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.623 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 36.4 m -151.07 10.76 0.61 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.006 178.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -73.29 132.24 42.87 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.314 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 70.49 34.42 67.95 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.898 -0.592 . . . . 0.0 113.758 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -88.39 -49.6 6.84 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.332 -0.511 . . . . 0.0 110.731 176.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 105.21 150.84 20.14 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -171.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.01 -41.78 92.88 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.108 0.454 . . . . 0.0 112.104 -171.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -68.06 -38.89 82.96 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.706 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.75 -43.41 65.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.946 0.403 . . . . 0.0 110.415 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 34.2 t -54.76 120.27 6.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.171 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 12.0 tptt -89.28 123.03 33.11 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.0 m -58.92 -50.87 85.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -174.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 456' ' ' SER . 25.2 Cg_endo -61.37 -30.88 88.12 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 121.61 1.54 . . . . 0.0 111.811 178.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.73 -46.18 22.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.371 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 468' ' ' ASP . 66.3 m -148.15 143.23 26.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.102 0.477 . . . . 0.0 110.808 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -79.32 159.16 27.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.69 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.635 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 39.2 t-105 -102.09 124.12 47.14 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -106.71 59.61 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.359 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.49 -55.04 4.08 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.604 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.8 31.41 0.61 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.308 -0.717 . . . . 0.0 111.308 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 40.2 m -143.17 129.09 19.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.507 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.635 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 46.9 t -91.81 117.08 29.44 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.08 134.61 1.6 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.552 ' HB2' ' HA ' ' A' ' 459' ' ' CYS . 32.0 t70 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.362 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 422' ' ' THR . . . . . 0.518 ' HB ' ' H ' ' A' ' 423' ' ' LYS . 1.0 OUTLIER -87.32 -145.6 0.13 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.636 0.255 . . . . 0.0 111.37 179.184 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.518 ' H ' ' HB ' ' A' ' 422' ' ' THR . 21.9 pttp -69.84 -33.92 72.94 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.732 0.301 . . . . 0.0 111.132 -178.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -148.34 127.18 12.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.08 -178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 20.1 m -93.41 41.96 1.09 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.312 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 20.7 tptm 67.45 118.13 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.767 0.827 . . . . 0.0 111.643 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 14.4 p 49.83 47.17 23.43 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.795 -179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 172.77 132.46 1.52 Allowed Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 111.314 -0.714 . . . . 0.0 111.314 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.699 ' HB ' HG11 ' A' ' 431' ' ' VAL . 13.4 m -131.72 125.55 20.49 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-O 121.147 0.499 . . . . 0.0 111.971 -177.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -88.73 45.07 0.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.374 2.716 . . . . 0.0 111.23 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.699 HG11 ' HB ' ' A' ' 429' ' ' VAL . 31.3 m -83.3 -7.56 10.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.13 -173.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 33.1 m 70.06 -68.08 0.21 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.145 178.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -143.89 -48.56 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.328 0.109 . . . . 0.0 111.023 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 434' ' ' THR . . . . . 0.512 ' OG1' ' HB ' ' A' ' 431' ' ' VAL . 23.7 m 62.21 55.21 2.46 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.701 0.762 . . . . 0.0 110.795 -177.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -84.89 144.06 28.62 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.507 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 436' ' ' THR . . . . . 0.586 ' HB ' ' HA ' ' A' ' 440' ' ' ASP . 3.3 p 49.93 54.26 11.38 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.552 0.691 . . . . 0.0 111.09 -173.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -63.71 -47.89 79.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.57 -173.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -62.4 -41.06 99.78 Favored Glycine 0 C--O 1.235 0.189 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.083 -178.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -164.91 126.05 2.05 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 177.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . 0.586 ' HA ' ' HB ' ' A' ' 436' ' ' THR . 19.3 m-20 -72.4 125.63 27.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.014 -179.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 3.8 p -72.62 -40.11 66.73 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.064 0.459 . . . . 0.0 110.075 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.511 HG23 ' HD2' ' A' ' 445' ' ' LYS . 54.7 m -80.38 124.63 29.04 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.769 175.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -78.88 -49.48 12.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.276 0.56 . . . . 0.0 110.048 176.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -83.27 72.54 10.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.871 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.752 ' HE2' ' HB3' ' A' ' 468' ' ' ASP . 14.3 mmmm -73.86 53.94 0.48 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.158 177.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.448 ' SG ' ' HD3' ' A' ' 449' ' ' LYS . 11.8 t 74.29 16.21 3.43 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 122.09 0.948 . . . . 0.0 109.36 -173.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 89.2 tttt -70.6 126.23 29.04 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.146 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 131.97 -30.56 3.19 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.193 -178.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.448 ' HD3' ' SG ' ' A' ' 446' ' ' CYS . 30.9 mtpp -76.07 137.47 40.2 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.257 0.551 . . . . 0.0 111.123 -177.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -78.48 162.25 49.14 Favored Glycine 0 C--O 1.22 -0.728 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.372 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.86 -35.32 76.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.718 0.759 . . . . 0.0 110.648 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -84.16 40.52 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.305 0.574 . . . . 0.0 110.316 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -164.09 -50.39 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.867 -177.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.86 132.83 40.59 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.402 ' C ' ' HD3' ' A' ' 457' ' ' PRO . 21.5 tptm -144.61 45.95 1.38 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.789 0.804 . . . . 0.0 110.779 -171.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.666 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 20.3 m 44.25 44.47 1.55 Allowed Pre-proline 0 C--N 1.314 -0.95 0 CA-C-N 114.084 -1.416 . . . . 0.0 114.266 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.589 ' HD3' ' N ' ' A' ' 456' ' ' SER . 4.5 Cg_endo -82.05 -48.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.921 1.747 . . . . 0.0 110.326 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.471 ' H ' ' HD2' ' A' ' 457' ' ' PRO . 8.5 t70 -148.25 37.9 0.86 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 173.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.666 ' O ' ' HA ' ' A' ' 456' ' ' SER . 4.0 m -148.64 132.66 17.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.85 -172.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.33 136.58 45.81 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.189 177.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.466 ' HE3' ' SG ' ' A' ' 466' ' ' CYS . 32.2 t-105 -85.93 126.45 34.11 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.031 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.59 121.33 9.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.761 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 55.53 45.75 83.34 Favored Glycine 0 N--CA 1.453 -0.191 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.999 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.78 35.94 92.0 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.589 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 60.9 m -155.17 134.22 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -85.52 130.63 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.018 178.686 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.608 ' HA ' ' O ' ' A' ' 445' ' ' LYS . 20.7 pttp -168.28 133.8 1.82 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.752 ' HB3' ' HE2' ' A' ' 445' ' ' LYS . 60.4 t0 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.964 -0.541 . . . . 0.0 109.773 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 111.79 -0.524 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 28.5 m -67.12 115.37 6.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.785 0.326 . . . . 0.0 111.143 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -78.86 -47.08 17.26 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . 0.423 ' HB1' ' H ' ' A' ' 425' ' ' SER . . . 58.43 -155.18 0.35 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.657 178.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 425' ' ' SER . . . . . 0.423 ' H ' ' HB1' ' A' ' 424' ' ' ALA . 13.3 m 64.03 176.84 0.17 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.162 -177.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . 0.53 ' NZ ' ' HB3' ' A' ' 426' ' ' LYS . 8.1 mtpm? -82.88 46.1 1.06 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.129 0.49 . . . . 0.0 110.094 176.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 11.2 m -69.67 131.88 45.3 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.37 -176.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -83.98 -147.64 8.15 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.749 -0.739 . . . . 0.0 111.662 176.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 10.4 t -94.76 117.45 66.91 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.757 ' HG2' ' HE3' ' A' ' 449' ' ' LYS . 57.1 Cg_endo -76.18 59.22 5.9 Favored 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.859 2.373 . . . . 0.0 113.278 -175.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 3.2 t -81.19 49.9 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 33.6 m 66.86 -75.05 0.06 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.768 -173.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 52.28 -155.59 0.17 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.371 0.668 . . . . 0.0 112.593 172.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 2.7 m -66.48 -42.67 87.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.038 -176.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -57.79 -29.36 64.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.128 -179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 3.5 m 64.35 51.36 2.09 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -176.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -68.68 69.8 0.17 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.181 -174.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . 0.577 ' HA3' ' HA ' ' A' ' 445' ' ' LYS . . . 177.72 36.89 0.06 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 178.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -92.99 34.76 1.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.944 0.402 . . . . 0.0 111.076 -179.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -74.63 156.12 37.08 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 13.1 t -61.95 -24.06 66.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.258 0.551 . . . . 0.0 110.316 178.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.487 HG22 ' HG2' ' A' ' 444' ' ' GLU . 25.7 m -71.39 -11.54 60.94 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.059 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 74.91 -32.87 0.23 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.856 0.862 . . . . 0.0 112.317 179.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 468' ' ' ASP . 13.5 mm-40 -59.4 116.87 4.24 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.924 0.392 . . . . 0.0 110.339 -174.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.577 ' HA ' ' HA3' ' A' ' 438' ' ' GLY . 52.0 mtmt -71.29 -31.17 67.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.654 -179.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.68 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 34.3 m -72.26 -32.71 66.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.247 -178.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 83.1 tttt -56.51 133.33 53.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.628 -177.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 102.18 -28.59 15.25 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.746 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.757 ' HE3' ' HG2' ' A' ' 430' ' ' PRO . 62.6 mtpt -65.1 144.15 57.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.004 0.43 . . . . 0.0 111.71 -177.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 162.61 54.72 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.457 178.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -59.78 -42.92 94.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.299 0.549 . . . . 0.0 111.051 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -65.83 -36.39 83.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.782 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -75.15 -45.62 39.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.743 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 51.0 t -56.68 119.07 5.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.282 -178.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -81.04 109.44 15.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.517 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.6 m -59.97 -48.66 94.16 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -171.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.0 Cg_endo -58.28 -38.74 89.53 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 121.175 1.25 . . . . 0.0 111.356 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -77.16 -47.99 18.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.4 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.607 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 16.5 m -127.06 132.6 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -79.99 130.82 35.57 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.941 0.401 . . . . 0.0 110.913 -176.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -82.3 122.46 27.98 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -166.44 137.65 3.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.718 0.294 . . . . 0.0 110.485 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 69.77 37.03 75.61 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.453 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 58.12 34.6 73.74 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.393 -0.432 . . . . 0.0 112.773 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 6.1 t -167.68 157.6 10.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.014 0.435 . . . . 0.0 110.119 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.68 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 14.4 t -82.36 120.8 25.89 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.469 -176.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.518 ' O ' ' HB3' ' A' ' 459' ' ' CYS . 74.1 mmtt -90.73 146.51 23.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.751 0.31 . . . . 0.0 111.066 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.585 ' HB3' ' HB3' ' A' ' 444' ' ' GLU . 40.3 t0 . . . . . 0 C--O 1.246 0.92 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.033 0 N-CA-C 112.121 -0.392 . . . . 0.0 112.121 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 22.0 m -66.0 128.23 35.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.533 0.206 . . . . 0.0 110.52 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.809 ' HE2' ' HA ' ' A' ' 423' ' ' LYS . 0.5 OUTLIER -69.09 -40.83 78.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.624 0.249 . . . . 0.0 110.776 -178.511 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . 0.526 ' HB1' ' H ' ' A' ' 425' ' ' SER . . . 63.76 -148.29 0.31 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.282 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 425' ' ' SER . . . . . 0.526 ' H ' ' HB1' ' A' ' 424' ' ' ALA . 19.1 m 56.35 40.64 29.71 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 121.372 0.606 . . . . 0.0 110.168 -176.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -76.11 133.38 40.29 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.356 -177.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 15.3 m 58.89 35.41 24.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.967 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 174.75 44.5 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.874 -178.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.466 HG22 ' HD2' ' A' ' 430' ' ' PRO . 8.5 p -69.4 131.79 89.96 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 176.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.466 ' HD2' HG22 ' A' ' 429' ' ' VAL . 53.8 Cg_exo -55.12 -52.42 7.93 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.719 2.279 . . . . 0.0 112.057 -176.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 20.5 t -84.31 63.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.221 0.534 . . . . 0.0 109.77 174.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 432' ' ' THR . . . . . 0.431 HG23 ' HG3' ' A' ' 433' ' ' GLN . 9.9 t -70.86 -34.08 71.27 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.853 -175.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.431 ' HG3' HG23 ' A' ' 432' ' ' THR . 25.2 mt-30 -101.6 150.87 22.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.952 178.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 18.4 p -79.95 142.77 34.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.571 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.12 -37.66 86.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.017 0.437 . . . . 0.0 110.498 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 25.4 m -86.78 139.05 31.09 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.908 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 65.59 41.4 4.1 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.528 0.517 . . . . 0.0 110.663 -176.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . 0.44 ' C ' ' H ' ' A' ' 440' ' ' ASP . . . -83.53 -45.66 6.38 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.823 178.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 70.87 -32.86 0.25 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.573 0.749 . . . . 0.0 112.665 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . 0.44 ' H ' ' C ' ' A' ' 438' ' ' GLY . 51.7 m-20 -58.41 137.67 57.12 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 122.235 0.214 . . . . 0.0 111.032 -178.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 1.7 m 61.25 38.42 16.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.104 -178.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 28.0 m 69.03 128.2 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.388 -178.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -82.32 47.22 1.12 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.31 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 55.73 55.56 7.01 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.632 177.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -74.83 -44.04 51.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.477 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 73.0 m -80.23 -44.44 19.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.567 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.2 tptt -60.33 113.66 2.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.727 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 127.01 -25.56 5.22 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.602 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 454' ' ' CYS . 55.3 mtpt -75.45 141.28 43.17 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 120.933 0.397 . . . . 0.0 111.032 -177.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.31 158.2 50.45 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.961 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . 0.539 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 38.9 tt0 -60.25 -36.9 78.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.962 0.381 . . . . 0.0 111.346 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -83.8 37.83 0.61 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.223 0.535 . . . . 0.0 110.844 178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.496 ' OD2' ' HE3' ' A' ' 449' ' ' LYS . 29.4 t70 -163.52 -50.13 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.909 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.499 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 1.7 t -68.12 125.67 27.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.461 176.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 41.6 mmtm -92.26 135.64 33.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -178.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.5 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 23.1 t -60.56 -50.0 87.47 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 26.7 Cg_exo -62.42 -29.12 78.79 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.632 1.554 . . . . 0.0 111.504 178.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.43 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 38.0 t70 -80.8 -42.32 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.241 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.84 134.47 24.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -66.23 115.87 6.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.941 0.401 . . . . 0.0 111.23 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.539 ' CZ2' ' HB2' ' A' ' 451' ' ' GLU . 48.9 t-105 -85.44 119.38 25.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 172.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -154.58 126.03 7.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.695 0.283 . . . . 0.0 110.734 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.58 33.08 75.74 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.082 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.43 39.21 97.48 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 121.188 -0.53 . . . . 0.0 112.37 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.8 t -165.9 145.16 6.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.1 OUTLIER -86.21 135.51 33.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 -175.571 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -130.88 139.72 50.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.009 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 33.4 t70 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.785 -0.626 . . . . 0.0 109.991 178.778 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . 0.547 ' O ' HG22 ' A' ' 422' ' ' THR . . . . . . . . 0 N--CA 1.487 2.08 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 422' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 421' ' ' GLY . 9.8 t 44.23 -128.88 0.93 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.746 0.818 . . . . 0.0 111.122 -176.783 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 424' ' ' ALA . 56.2 mtmt -63.56 132.36 50.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 118.076 0.398 . . . . 0.0 110.393 179.104 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 423' ' ' LYS . . . 73.41 137.43 0.05 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 124.055 0.847 . . . . 0.0 111.002 -174.888 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.4 t -64.7 -44.15 91.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.768 -176.237 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.6 136.89 19.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 0.0 110.239 177.123 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 11.6 p -158.62 40.73 0.24 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.716 -176.093 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -71.75 135.8 23.68 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.753 177.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.461 HG21 ' HD2' ' A' ' 430' ' ' PRO . 5.4 p -137.07 131.4 17.81 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -178.733 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.461 ' HD2' HG21 ' A' ' 429' ' ' VAL . 50.7 Cg_exo -58.62 -55.13 2.26 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.596 2.198 . . . . 0.0 112.974 -174.444 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 12.2 t 57.55 42.82 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-O 121.927 0.87 . . . . 0.0 109.68 -177.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.9 p -92.59 44.54 1.16 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.562 -176.469 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -87.0 130.13 34.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.352 177.943 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 5.8 t -164.76 123.53 1.78 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.11 0.481 . . . . 0.0 110.854 -179.676 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -149.72 133.87 17.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.476 179.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.9 m -70.99 120.34 16.42 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.12 -52.06 57.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.557 -174.201 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -170.09 59.08 0.19 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.319 -179.356 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -162.53 36.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.097 0.475 . . . . 0.0 110.883 -178.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -82.04 113.81 20.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.312 177.695 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.437 HG21 HG23 ' A' ' 442' ' ' THR . 89.0 m 69.42 -57.07 0.54 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.515 -175.047 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.437 HG23 HG21 ' A' ' 441' ' ' THR . 9.3 t -175.29 153.98 1.64 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -178.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -61.6 117.79 6.22 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 177.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.93 ' HG3' ' HB3' ' A' ' 447' ' ' LYS . 30.8 tt0 -74.06 115.0 13.03 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.153 0.501 . . . . 0.0 111.317 -176.99 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.504 ' HB3' ' OD2' ' A' ' 468' ' ' ASP . 6.2 ttpm? -137.32 -44.56 0.55 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.107 -0.952 . . . . 0.0 108.516 176.725 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.538 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 46.0 m -87.4 -30.81 20.45 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.66 -1.155 . . . . 0.0 110.753 175.762 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.93 ' HB3' ' HG3' ' A' ' 444' ' ' GLU . 62.8 tttm -62.46 133.5 55.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.372 -175.414 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.93 53.87 6.08 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.288 176.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.801 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 49.9 mtpt -122.17 -50.71 2.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.994 0.426 . . . . 0.0 111.44 178.238 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 126.53 156.01 9.08 Favored Glycine 0 N--CA 1.444 -0.803 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -172.003 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -61.84 -41.97 98.46 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.323 0.562 . . . . 0.0 111.392 -173.369 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.6 pttm -71.95 -34.78 69.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.624 179.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.801 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -75.51 -40.19 57.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.388 -179.033 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.8 t -59.9 118.62 6.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.176 179.025 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -74.72 123.25 24.58 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.235 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.446 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 46.0 m -71.13 -51.57 10.28 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -173.349 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 456' ' ' SER . 28.6 Cg_endo -63.61 -27.33 69.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.512 1.475 . . . . 0.0 111.871 -179.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -97.39 -33.17 11.51 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.479 -174.278 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.2 m -129.98 150.27 51.34 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 122.127 -0.358 . . . . 0.0 110.974 -172.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.458 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 63.5 mttm -86.87 139.11 30.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.33 -179.119 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.454 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.2 t-105 -111.78 122.74 48.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.539 ' HB3' ' HE3' ' A' ' 467' ' ' LYS . 69.4 tt0 -158.58 134.54 9.04 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.513 0.196 . . . . 0.0 110.866 -175.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.35 31.63 81.05 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.354 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.53 37.83 94.94 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.171 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.8 t -165.35 146.91 7.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.097 0.475 . . . . 0.0 110.711 179.398 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.538 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.7 t -87.11 147.49 25.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.094 -175.22 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.71 142.72 27.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.973 0.416 . . . . 0.0 110.456 178.565 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.504 ' OD2' ' HB3' ' A' ' 445' ' ' LYS . 2.6 m-20 . . . . . 0 C--O 1.254 1.317 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.356 -179.128 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.836 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 15.0 m -71.95 120.0 16.93 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.968 0.413 . . . . 0.0 111.022 -178.383 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -82.24 -42.02 19.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.505 177.023 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 68.36 -78.16 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 O-C-N 124.239 0.962 . . . . 0.0 110.871 -177.44 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.6 t -88.62 143.13 27.15 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 176.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -156.02 157.36 36.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.713 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.6 m 73.42 -47.32 0.66 Allowed 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.792 0.683 . . . . 0.0 111.571 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 179.5 162.03 27.91 Favored Glycine 0 N--CA 1.442 -0.94 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.715 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.41 ' C ' ' H ' ' A' ' 431' ' ' VAL . 58.5 t -58.87 132.59 86.69 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.64 0.22 . . . . 0.0 110.535 179.165 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -70.8 38.59 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.983 2.455 . . . . 0.0 113.057 -177.119 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' A' ' 429' ' ' VAL . 7.7 p -83.74 63.22 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.951 0.882 . . . . 0.0 110.027 175.497 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 2.5 m -74.63 56.27 0.69 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.134 -176.449 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -158.36 48.33 0.36 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -177.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 66.6 p 53.64 -154.56 0.24 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.963 -175.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -148.8 143.57 26.43 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 -177.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 9.1 m -100.6 -54.04 2.94 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.463 -179.454 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 176.68 -54.48 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.139 176.681 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -162.1 30.71 0.3 Allowed Glycine 0 N--CA 1.451 -0.305 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 179.025 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -164.25 43.46 0.1 Allowed 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 178.866 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.83 -37.78 88.65 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.149 -173.615 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.1 p -76.51 39.23 0.2 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.376 -179.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.433 ' O ' ' HB1' ' A' ' 443' ' ' ALA . 21.4 m -65.18 -62.56 1.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.06 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . 0.433 ' HB1' ' O ' ' A' ' 442' ' ' THR . . . 170.22 -42.28 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.304 175.292 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.647 ' HG2' ' HB3' ' A' ' 447' ' ' LYS . 22.3 mt-10 61.52 40.93 13.14 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.813 -175.47 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.572 ' HZ3' ' HB3' ' A' ' 445' ' ' LYS . 6.3 ttpm? -66.17 -45.72 79.9 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.933 172.628 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 10.7 t -98.34 -41.03 8.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.554 177.262 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.647 ' HB3' ' HG2' ' A' ' 444' ' ' GLU . 26.5 ttpp -58.62 125.2 22.44 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.349 -175.048 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.1 -20.52 4.49 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.255 -176.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.869 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 29.7 mtpt -93.45 -152.74 0.34 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.224 -178.113 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -127.83 160.94 21.82 Favored Glycine 0 C--O 1.219 -0.794 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.654 177.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -42.6 -43.08 3.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -174.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -64.0 -42.9 97.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.232 -178.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.75 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 46.6 m-20 -73.11 -51.08 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.658 0.742 . . . . 0.0 109.6 175.247 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.869 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 77.5 m -72.6 53.83 0.32 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 124.907 1.283 . . . . 0.0 111.472 177.391 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.604 ' HE2' ' HG2' ' A' ' 457' ' ' PRO . 20.6 ptmt -63.12 141.95 58.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.556 -177.357 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.506 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 7.3 t -50.4 -48.54 80.85 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.568 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.604 ' HG2' ' HE2' ' A' ' 455' ' ' LYS . 13.5 Cg_endo -57.63 -37.38 97.09 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 121.769 1.646 . . . . 0.0 112.621 -179.367 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -85.42 -36.82 20.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 82.0 m -138.54 135.54 35.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.006 -173.026 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.693 ' HB3' ' HB2' ' A' ' 467' ' ' LYS . 83.1 tttt -72.19 143.79 48.76 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 175.076 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.684 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 44.2 t-105 -116.49 126.68 53.7 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.08 -176.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.674 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 41.9 tt0 -95.99 -65.64 0.96 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 0.0 110.896 -179.11 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -179.24 87.34 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 68.56 31.65 73.94 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.744 -175.861 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.4 t -166.2 130.17 2.13 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -179.599 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.684 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 1.7 m -77.99 140.73 39.21 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.098 -177.233 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.693 ' HB2' ' HB3' ' A' ' 460' ' ' LYS . 27.1 mmmt -93.72 171.32 8.96 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.465 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.563 ' OD1' ' HB3' ' A' ' 445' ' ' LYS . 31.4 t70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.802 -169.6 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.741 0 N-CA-C 111.957 -0.457 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 422' ' ' THR . . . . . 0.43 ' HB ' ' HD3' ' A' ' 426' ' ' LYS . 4.7 m -62.08 -48.94 77.95 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.685 0.243 . . . . 0.0 110.931 -178.618 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp 55.97 -135.42 1.29 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.77 179.73 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 55.58 41.94 30.14 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 122.583 0.353 . . . . 0.0 111.417 178.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 37.4 m 61.04 71.53 0.56 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.341 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . 0.43 ' HD3' ' HB ' ' A' ' 422' ' ' THR . 14.0 mmmm -52.49 127.31 22.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.81 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 6.1 p -172.85 -41.41 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.934 -178.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 77.74 -59.33 3.8 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.4 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 8.0 p 34.72 65.02 1.69 Allowed Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 123.962 0.905 . . . . 0.0 112.094 178.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -76.78 43.8 1.32 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.608 2.205 . . . . 0.0 112.742 -177.026 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.429 ' C ' ' HG1' ' A' ' 432' ' ' THR . 7.3 p -71.83 121.82 22.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 176.884 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 432' ' ' THR . . . . . 0.586 HG23 ' HB3' ' A' ' 435' ' ' GLN . 2.2 m -157.9 49.56 0.41 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.233 0.539 . . . . 0.0 109.956 -173.761 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -74.86 -40.87 60.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.794 -179.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 3.7 p -84.35 43.62 0.97 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.885 176.227 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . 0.586 ' HB3' HG23 ' A' ' 432' ' ' THR . 20.2 pt20 -70.18 137.8 51.28 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.065 -177.312 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 14.5 t -175.17 147.19 0.89 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.629 179.573 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -77.56 -155.5 0.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.823 0.344 . . . . 0.0 110.825 -178.545 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 179.3 -129.9 1.44 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 111.572 -0.611 . . . . 0.0 111.572 179.47 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 59.25 55.66 4.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.977 0.418 . . . . 0.0 110.662 179.544 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -155.32 116.61 3.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.781 -178.652 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 1.8 p -106.72 -26.94 11.09 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.032 -177.493 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.502 HG21 ' HB2' ' A' ' 468' ' ' ASP . 34.8 m -63.03 -53.16 58.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.338 -178.792 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 66.94 -11.41 0.26 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.179 0.591 . . . . 0.0 112.366 -179.43 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.487 ' H ' ' C ' ' A' ' 442' ' ' THR . 86.3 mt-10 58.61 44.83 16.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.232 0.539 . . . . 0.0 110.868 -177.55 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.427 ' HE2' ' HB3' ' A' ' 445' ' ' LYS . 2.5 tmmm? -69.52 -39.34 77.6 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 174.226 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.836 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 21.4 m -117.38 -27.98 6.24 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.754 179.119 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.631 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 64.2 tttp -54.57 110.57 0.65 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.754 -176.189 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 112.55 -19.35 21.85 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.747 -0.74 . . . . 0.0 113.096 -178.533 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.8 ' HE3' ' HB3' ' A' ' 453' ' ' ASP . 31.1 mmmt -68.86 142.8 54.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 117.01 0.405 . . . . 0.0 111.335 -178.152 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -68.2 163.32 48.5 Favored Glycine 0 C--O 1.224 -0.502 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 175.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -55.01 -45.09 75.06 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -175.458 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -65.37 -44.84 86.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.898 0.38 . . . . 0.0 110.595 -179.008 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.8 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -67.13 -44.75 79.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.157 179.226 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 33.4 t -64.88 122.12 16.22 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.49 -175.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 68.4 mttm -76.27 122.53 24.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.701 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.512 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 19.4 m -68.39 -50.31 28.4 Favored Pre-proline 0 C--N 1.322 -0.589 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -174.55 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.512 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 21.3 Cg_exo -65.01 -37.58 32.61 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 121.247 1.298 . . . . 0.0 110.974 179.076 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.423 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 7.7 t70 -71.28 -39.54 71.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.368 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 54.6 m -138.65 140.34 38.83 Favored 'General case' 0 N--CA 1.458 -0.053 0 CA-C-O 121.24 0.543 . . . . 0.0 112.091 -174.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.436 ' O ' ' HG2' ' A' ' 467' ' ' LYS . 62.0 tttp -71.17 135.62 47.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.739 -178.17 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.614 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.4 t-105 -100.77 107.89 19.57 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 174.354 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.563 ' HB3' HG22 ' A' ' 465' ' ' THR . 22.8 tt0 -82.7 50.8 1.75 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.019 0.437 . . . . 0.0 110.875 -177.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 54.61 31.68 53.0 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.699 -0.682 . . . . 0.0 113.755 177.931 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 161.45 -40.57 0.4 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.8 179.064 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.563 HG22 ' HB3' ' A' ' 462' ' ' GLU . 9.7 t -115.37 134.56 54.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.247 0.546 . . . . 0.0 110.812 179.72 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.836 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 47.4 t -81.95 140.24 34.13 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.633 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.481 ' CD ' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.34 147.21 30.1 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.417 0.627 . . . . 0.0 111.192 -174.352 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.502 ' HB2' HG21 ' A' ' 442' ' ' THR . 19.9 m-20 . . . . . 0 C--N 1.316 -0.88 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.94 -179.473 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.746 0 N-CA-C 112.17 -0.372 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 6.7 t -75.78 140.87 42.59 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 120.885 0.374 . . . . 0.0 110.038 178.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -86.83 72.91 10.07 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.709 -178.084 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 72.14 -53.68 0.69 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.582 -177.168 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 69.6 m -155.27 110.95 3.09 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.588 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . 0.404 ' HB3' ' H ' ' A' ' 427' ' ' SER . 99.8 mttt 55.27 -145.96 0.6 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.127 -176.769 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 427' ' ' SER . . . . . 0.404 ' H ' ' HB3' ' A' ' 426' ' ' LYS . 3.4 p -83.66 61.03 6.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.875 0.369 . . . . 0.0 111.388 179.252 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -64.25 125.14 31.31 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.069 -179.827 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 20.4 t 55.45 69.7 1.86 Allowed Pre-proline 0 C--O 1.235 0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 110.484 -177.355 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.08 121.88 9.11 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.39 2.06 . . . . 0.0 112.019 -177.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 435' ' ' GLN . 7.4 p -70.19 128.61 33.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.158 178.002 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 19.0 p -138.05 47.6 2.01 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.438 -176.099 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 73.07 139.33 0.06 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.404 -176.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 67.9 p 50.17 49.11 21.07 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.688 -175.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 431' ' ' VAL . 45.1 tp60 70.44 -81.25 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.807 -172.139 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 15.3 t 179.11 133.19 0.09 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.04 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . 0.425 ' HB1' ' H ' ' A' ' 438' ' ' GLY . . . 57.46 -136.4 1.03 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.586 -175.514 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . 0.425 ' H ' ' HB1' ' A' ' 437' ' ' ALA . . . -169.04 133.44 2.86 Favored Glycine 0 N--CA 1.443 -0.857 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 179.198 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 56.99 59.23 3.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.866 0.365 . . . . 0.0 110.614 -178.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . 0.546 ' O ' ' HB ' ' A' ' 441' ' ' THR . 12.7 p-10 -58.62 117.22 4.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.551 -177.987 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.546 ' HB ' ' O ' ' A' ' 440' ' ' ASP . 14.9 t 165.42 -28.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.953 -177.776 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.86 HG22 ' HA ' ' A' ' 445' ' ' LYS . 3.2 t -161.37 136.43 7.48 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.451 177.177 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -64.21 -57.01 10.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.911 -173.537 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.488 ' HG2' ' N ' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -117.15 16.26 14.95 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.471 0.653 . . . . 0.0 111.356 -175.871 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.86 ' HA ' HG22 ' A' ' 442' ' ' THR . 24.1 mtmm 62.8 31.63 16.37 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.654 -1.157 . . . . 0.0 109.665 -177.377 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.623 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 75.0 m 69.69 13.29 8.16 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 113.93 -1.486 . . . . 0.0 111.849 176.805 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 444' ' ' GLU . 40.8 ttmt -57.67 117.92 4.72 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.011 -176.815 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 56.35 46.32 87.11 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.308 -0.86 . . . . 0.0 113.822 173.842 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.575 ' HD2' ' HA ' ' A' ' 454' ' ' CYS . 12.4 ptpt -90.89 -41.37 11.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 117.203 0.501 . . . . 0.0 111.849 -179.65 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 123.91 151.68 8.24 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.999 -178.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . 0.456 ' C ' ' H ' ' A' ' 453' ' ' ASP . 6.4 tm-20 -66.28 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.563 0.181 . . . . 0.0 111.033 -176.049 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -79.15 38.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.175 0.512 . . . . 0.0 110.52 177.676 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.456 ' H ' ' C ' ' A' ' 451' ' ' GLU . 50.6 t0 -166.22 -43.85 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.496 -178.93 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.575 ' HA ' ' HD2' ' A' ' 449' ' ' LYS . 53.7 t -64.16 112.15 2.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.242 -176.072 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.463 ' HE3' ' HB2' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -170.65 138.24 1.42 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.432 168.911 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.562 ' C ' ' H ' ' A' ' 458' ' ' ASP . 12.2 t 170.04 142.15 0.08 OUTLIER Pre-proline 0 C--N 1.315 -0.928 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.2 -176.254 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.77 8.27 1.04 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 121.603 1.535 . . . . 0.0 110.008 172.753 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.562 ' H ' ' C ' ' A' ' 456' ' ' SER . 87.8 m-20 -115.17 -52.17 2.69 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.992 177.972 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 63.8 m -82.44 131.59 35.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.691 179.74 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.48 141.71 44.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.256 -178.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -85.87 123.51 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.699 176.218 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.576 ' HB3' HG21 ' A' ' 465' ' ' THR . 9.4 tp10 -103.87 55.83 0.73 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.855 0.36 . . . . 0.0 110.711 -176.313 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.62 -52.16 3.11 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.199 -0.524 . . . . 0.0 113.359 179.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -152.2 33.88 0.85 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.09 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.576 HG21 ' HB3' ' A' ' 462' ' ' GLU . 9.5 t -171.4 134.08 0.86 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.881 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.623 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.8 t -91.98 140.66 29.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.286 -0.416 . . . . 0.0 109.911 -176.848 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -168.21 136.56 2.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.159 0.504 . . . . 0.0 111.414 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 56.8 t0 . . . . . 0 C--O 1.248 1.014 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.323 175.674 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.757 0 N-CA-C 111.941 -0.463 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 422' ' ' THR . . . . . 0.475 HG22 ' N ' ' A' ' 423' ' ' LYS . 11.7 t -84.57 -36.11 22.32 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.884 0.373 . . . . 0.0 110.758 -179.311 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.475 ' N ' HG22 ' A' ' 422' ' ' THR . 14.3 ttpp -84.97 53.55 2.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.156 0.503 . . . . 0.0 110.941 179.996 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -100.9 123.14 44.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.686 179.116 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 18.3 t 58.68 39.07 24.86 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.569 0.543 . . . . 0.0 110.937 179.521 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . 0.401 ' HG3' ' HA ' ' A' ' 423' ' ' LYS . 30.3 mmmt -88.0 -31.74 19.19 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 178.516 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 32.6 t 71.72 145.42 0.07 Allowed 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.661 0.601 . . . . 0.0 110.662 -178.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -65.62 -58.93 8.31 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.691 -175.367 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 85.0 t -144.23 121.21 6.49 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-O 120.546 0.212 . . . . 0.0 110.521 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.53 128.32 16.06 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.379 2.053 . . . . 0.0 110.957 175.882 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 20.8 m -61.5 127.9 22.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.487 0.661 . . . . 0.0 111.85 -174.808 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.3 p -87.27 -45.13 10.89 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.404 178.178 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -135.43 -142.3 0.18 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.825 178.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 24.9 m -80.33 131.57 35.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.757 0.313 . . . . 0.0 110.462 178.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -68.27 159.64 30.87 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.7 -177.74 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.1 p -55.67 135.98 50.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.995 -178.62 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.66 -47.6 38.6 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.397 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -178.8 -53.84 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.293 179.052 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -130.04 122.24 28.0 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 176.293 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -72.03 128.35 35.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.364 -175.144 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 5.6 t -168.2 120.21 0.84 Allowed 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.402 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 48.6 m 69.13 -65.96 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.887 -179.786 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -178.35 -45.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 176.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 445' ' ' LYS . 40.3 tt0 -155.54 45.22 0.47 Allowed 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 114.782 -1.099 . . . . 0.0 108.126 176.407 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.703 ' O ' ' HB2' ' A' ' 446' ' ' CYS . 60.7 mttp 73.63 -53.8 0.69 Allowed 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 114.165 -1.38 . . . . 0.0 110.425 -172.961 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.703 ' HB2' ' O ' ' A' ' 445' ' ' LYS . 6.4 t 157.37 7.51 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 O-C-N 124.695 1.247 . . . . 0.0 109.341 175.763 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -63.37 132.12 50.48 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.436 -175.111 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 138.56 -39.26 1.59 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.87 143.64 56.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.388 -0.406 . . . . 0.0 110.751 179.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.73 166.0 49.74 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 175.2 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . 0.6 ' HG2' ' H ' ' A' ' 452' ' ' LYS . 12.3 pm0 -55.07 -56.76 16.22 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.6 ' H ' ' HG2' ' A' ' 451' ' ' GLU . 1.3 mptm? -71.23 -37.11 72.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.853 0.358 . . . . 0.0 110.638 177.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -63.6 -34.06 76.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.86 -178.152 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.0 115.64 3.0 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.248 176.166 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -84.48 128.23 34.47 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -177.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.611 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 1.9 m -60.27 -54.53 54.24 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -171.909 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 46.6 Cg_exo -57.77 -33.31 96.68 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.733 1.622 . . . . 0.0 111.538 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -77.08 -49.16 15.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.439 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.615 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 25.2 m -151.69 136.36 17.07 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.411 -174.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -86.16 141.05 29.64 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.102 -0.374 . . . . 0.0 110.175 176.531 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -87.43 118.23 26.75 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.265 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.494 ' HB2' ' HE3' ' A' ' 467' ' ' LYS . 81.3 mt-10 -149.63 132.29 15.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.721 0.296 . . . . 0.0 110.998 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 59.17 38.01 92.53 Favored Glycine 0 N--CA 1.452 -0.245 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.517 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.81 38.54 96.12 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.145 -178.561 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 88.4 m -150.94 128.43 11.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.883 0.373 . . . . 0.0 110.945 -176.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.615 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 5.9 t -78.06 126.7 31.2 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.951 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.494 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 22.0 pttp -166.4 149.37 7.03 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.712 -175.549 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.9 t70 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.258 -0.877 . . . . 0.0 109.434 174.753 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.859 0 N-CA-C 112.259 -0.337 . . . . 0.0 112.259 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.05 38.72 1.44 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.996 0.427 . . . . 0.0 111.097 -179.552 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -79.26 52.28 1.31 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.631 179.568 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -164.59 124.31 1.94 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.325 178.144 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 17.9 p -169.14 133.61 1.45 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.308 179.627 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -83.56 42.73 0.85 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.947 0.403 . . . . 0.0 111.311 -178.612 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 7.4 t -89.5 125.22 35.1 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.902 0.382 . . . . 0.0 110.164 179.443 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 70.8 37.57 66.18 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.967 -0.56 . . . . 0.0 113.025 179.41 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 71.8 t -100.4 112.11 63.77 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.632 0.253 . . . . 0.0 110.401 177.743 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.13 125.95 13.73 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 122.679 2.253 . . . . 0.0 111.839 -179.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 55.4 t -82.2 123.99 38.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.239 178.585 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 17.1 m -75.3 -45.49 39.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.047 0.451 . . . . 0.0 110.156 179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -164.4 118.9 1.42 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.718 175.67 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 434' ' ' THR . . . . . 0.488 HG22 ' HG3' ' A' ' 435' ' ' GLN . 25.9 m -68.98 -62.85 1.2 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.563 -178.488 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . 0.488 ' HG3' HG22 ' A' ' 434' ' ' THR . 0.0 OUTLIER -179.28 133.79 0.12 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.155 177.867 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 13.5 p -93.61 -42.77 9.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.502 179.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 56.28 36.7 27.92 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.732 178.619 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 60.03 56.74 22.99 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.193 178.337 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . 0.456 ' HB2' ' HB ' ' A' ' 442' ' ' THR . . . 65.82 58.57 0.77 Allowed 'General case' 0 C--O 1.235 0.33 0 C-N-CA 122.62 0.368 . . . . 0.0 111.004 -177.328 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 72.64 -57.34 0.63 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.026 0.931 . . . . 0.0 112.302 -179.467 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.2 t -169.32 26.91 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.945 0.402 . . . . 0.0 110.606 179.288 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.65 HG22 ' HB3' ' A' ' 444' ' ' GLU . 54.7 m -74.39 -46.74 38.4 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.622 175.181 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 57.46 55.43 5.72 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -174.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.65 ' HB3' HG22 ' A' ' 442' ' ' THR . 22.2 pt-20 -70.12 57.43 0.16 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.778 -172.287 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -64.79 -35.89 82.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.403 178.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.528 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 12.6 t -75.21 -17.17 60.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.15 -177.541 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.615 ' HB2' ' HB2' ' A' ' 444' ' ' GLU . 17.9 tttp -54.59 124.69 17.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.057 0.455 . . . . 0.0 111.089 -176.029 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 83.07 26.99 42.31 Favored Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.51 -0.768 . . . . 0.0 114.647 173.277 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.891 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 42.6 mtpt -84.05 -25.78 29.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.049 0.925 . . . . 0.0 109.226 170.989 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 96.19 141.14 11.65 Favored Glycine 0 C--O 1.215 -1.071 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.619 -177.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -45.34 -43.74 11.1 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -171.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -57.89 -43.69 86.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.062 0.458 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.707 ' OD2' ' HE2' ' A' ' 449' ' ' LYS . 23.6 t0 -81.5 -45.3 16.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.332 179.524 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.891 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 70.9 m -71.64 64.58 0.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.892 1.277 . . . . 0.0 111.331 174.986 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -65.72 145.4 56.06 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.817 -178.102 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.518 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.0 m -56.2 -48.37 97.01 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -175.77 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.3 Cg_endo -62.31 -33.05 81.6 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 121.491 1.461 . . . . 0.0 111.712 177.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -79.96 -40.97 26.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.145 -178.469 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 97.9 m -146.14 142.24 28.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.512 -176.308 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -75.2 125.21 28.49 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.851 0.358 . . . . 0.0 110.791 179.367 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.711 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 26.9 t-105 -96.44 115.93 28.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.696 178.966 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -89.07 -47.37 8.15 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.922 0.391 . . . . 0.0 110.907 -178.381 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.76 65.85 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 82.69 37.94 12.85 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.513 -174.137 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -167.56 136.7 2.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.739 0.304 . . . . 0.0 110.393 178.569 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.711 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.0 OUTLIER -102.15 138.9 38.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.194 -176.405 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -172.93 -173.29 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.919 0.39 . . . . 0.0 110.614 176.796 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 31.7 t70 . . . . . 0 C--O 1.248 1.002 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.33 176.404 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 112.088 -0.405 . . . . 0.0 112.088 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 4.1 m 58.73 38.49 24.89 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.547 0.689 . . . . 0.0 110.447 -179.661 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -102.23 138.17 39.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.454 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -145.03 43.16 1.32 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.883 -178.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 8.6 t 62.15 -150.14 0.37 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.424 -178.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . 0.514 ' HD3' ' N ' ' A' ' 426' ' ' LYS . 0.0 OUTLIER -166.27 133.56 2.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -177.033 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 72.3 m 66.41 140.4 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.543 0.687 . . . . 0.0 112.04 -178.31 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -65.71 131.09 34.27 Favored Glycine 0 N--CA 1.447 -0.626 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.424 -177.561 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 7.5 p -167.82 126.85 1.02 Allowed Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.658 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -75.67 122.83 7.11 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.298 1.998 . . . . 0.0 111.738 -179.065 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 15.6 m -75.92 132.6 32.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.459 178.862 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 57.7 m 72.24 128.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.58 0.705 . . . . 0.0 111.462 -178.067 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -157.05 -53.03 0.08 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.485 178.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.29 123.58 3.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.526 174.885 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -72.21 -29.93 64.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.207 0.527 . . . . 0.0 109.949 177.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 10.7 t -167.79 134.4 2.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.177 178.407 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -164.77 140.2 5.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.872 0.368 . . . . 0.0 110.737 -175.244 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 162.98 -46.04 0.33 Allowed Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.242 179.269 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 58.2 50.37 9.94 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.377 0.608 . . . . 0.0 110.221 -176.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -157.19 147.94 21.47 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.523 -176.293 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.8 m 70.53 57.51 0.25 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.863 0.84 . . . . 0.0 110.488 -176.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.555 HG23 ' HB2' ' A' ' 445' ' ' LYS . 11.4 m -82.79 59.11 4.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.43 175.971 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . 0.471 ' C ' ' H ' ' A' ' 445' ' ' LYS . . . -69.04 -90.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.505 -170.797 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.53 ' HA ' ' HB3' ' A' ' 447' ' ' LYS . 37.7 tt0 -77.05 24.86 0.16 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -172.385 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.555 ' HB2' HG23 ' A' ' 442' ' ' THR . 13.6 mmmm -82.97 -36.29 25.24 Favored 'General case' 0 C--N 1.311 -1.109 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 163.725 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.471 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 57.6 m -106.4 -36.15 6.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.498 176.201 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 444' ' ' GLU . 19.5 tptm -64.74 128.38 35.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.113 0.482 . . . . 0.0 110.999 -175.592 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.78 22.2 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.496 -0.774 . . . . 0.0 113.25 177.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 446' ' ' CYS . 43.4 mtpt -99.04 -48.82 4.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.128 0.489 . . . . 0.0 110.406 174.127 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 102.75 153.61 24.6 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -175.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.04 -39.92 83.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.88 0.34 . . . . 0.0 111.434 -177.499 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -86.57 37.6 0.75 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.249 0.547 . . . . 0.0 111.08 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -157.06 -45.93 0.07 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.333 -0.848 . . . . 0.0 108.889 177.513 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.1 t -63.22 115.91 4.96 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.199 175.003 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.448 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 94.8 mttt -101.74 141.06 35.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.573 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.477 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 22.1 m -56.13 -50.47 87.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.282 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 456' ' ' SER . 32.8 Cg_endo -63.33 -31.64 73.11 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.535 1.49 . . . . 0.0 110.942 177.339 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.448 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 14.6 t70 -71.32 -52.38 19.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.715 179.56 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.479 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 70.8 m -156.65 147.52 21.86 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -178.8 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -81.1 122.87 27.88 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.817 -176.345 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -87.56 106.64 18.14 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 174.383 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -146.62 130.31 16.99 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -174.664 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.18 32.42 84.12 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.788 -175.016 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.48 24.01 69.02 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.282 -177.479 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 57.0 m -132.18 133.75 44.57 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 120.797 0.332 . . . . 0.0 110.459 -177.65 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 31.2 t -88.96 118.77 28.93 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.343 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -161.72 144.61 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -174.587 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.442 ' O ' ' HA ' ' A' ' 459' ' ' CYS . 9.8 t70 . . . . . 0 C--O 1.245 0.844 0 O-C-N 124.311 1.007 . . . . 0.0 110.972 -179.26 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.741 0 N-CA-C 112.004 -0.438 . . . . 0.0 112.004 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 5.1 p -67.12 -48.33 68.42 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.738 0.304 . . . . 0.0 110.804 179.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -75.16 139.7 42.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.338 177.004 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -75.4 56.79 0.87 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.967 0.413 . . . . 0.0 111.726 -178.556 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.8 m -66.83 132.37 47.87 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.334 178.919 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -70.82 124.27 23.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.351 0.596 . . . . 0.0 111.045 -178.39 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 22.7 t -90.82 -143.92 0.18 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.234 179.016 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -70.88 110.65 3.35 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 172.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 21.5 m -62.9 132.27 94.85 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-O 121.027 0.442 . . . . 0.0 111.483 -173.729 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -70.86 137.44 32.26 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.831 2.354 . . . . 0.0 112.098 -178.459 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 29.7 m -66.85 148.24 12.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.239 177.54 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 14.6 t -56.9 137.17 55.6 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 -178.719 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -58.93 129.3 41.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.875 -175.491 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 17.3 m -136.63 139.25 41.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.279 -177.504 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -51.97 -57.29 9.89 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.715 -175.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 4.8 t -175.46 66.27 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.589 0.709 . . . . 0.0 110.063 -175.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . 0.521 ' HB2' ' H ' ' A' ' 438' ' ' GLY . . . 60.52 -129.33 0.93 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.413 -176.502 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . 0.521 ' H ' ' HB2' ' A' ' 437' ' ' ALA . . . -86.2 38.02 3.09 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.735 178.375 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 70.25 139.46 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 123.478 0.711 . . . . 0.0 111.796 -179.176 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -83.04 42.57 0.81 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.968 177.43 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.6 p -64.77 -41.88 95.53 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 173.756 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 5.2 m -70.97 133.31 46.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.765 171.044 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . 0.456 ' C ' ' H ' ' A' ' 445' ' ' LYS . . . -58.76 140.71 54.55 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 123.176 0.297 . . . . 0.0 110.54 179.357 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.708 ' HA ' ' HB2' ' A' ' 447' ' ' LYS . 2.1 mp0 -79.33 27.92 0.25 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.72 -175.892 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.456 ' H ' ' C ' ' A' ' 443' ' ' ALA . 26.6 mtpp -71.92 -34.2 68.89 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 168.063 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.559 ' O ' ' HE2' ' A' ' 449' ' ' LYS . 57.9 m -113.38 -49.77 2.89 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 113.933 -1.485 . . . . 0.0 109.731 172.586 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.708 ' HB2' ' HA ' ' A' ' 444' ' ' GLU . 63.5 tttp 59.08 144.97 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.887 0.875 . . . . 0.0 112.844 176.706 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.517 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . -73.14 51.86 1.7 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.857 179.311 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.559 ' HE2' ' O ' ' A' ' 446' ' ' CYS . 33.6 mtmt -74.48 -152.21 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 179.773 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -83.26 156.23 33.59 Favored Glycine 0 N--CA 1.443 -0.88 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 174.234 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -41.07 98.53 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.685 0.279 . . . . 0.0 111.301 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -69.05 -34.05 74.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.835 0.35 . . . . 0.0 110.51 179.942 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.33 -51.83 27.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.663 176.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 16.0 t -53.67 129.84 34.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.032 174.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.97 116.81 23.58 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 173.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.564 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 25.0 m -65.93 -47.04 64.92 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.413 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.1 Cg_endo -57.98 -38.44 92.05 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.667 1.578 . . . . 0.0 111.645 177.591 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -76.76 -48.22 19.34 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.175 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.468 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 60.6 m -130.4 142.54 50.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 111.189 -175.178 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -76.95 133.98 39.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.072 0.463 . . . . 0.0 110.99 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -102.98 119.84 39.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.479 176.512 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.56 ' O ' HG21 ' A' ' 465' ' ' THR . 14.1 pt-20 -159.94 143.68 14.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.686 0.279 . . . . 0.0 110.674 178.684 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.17 32.1 79.33 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.285 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.13 41.82 99.63 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.975 179.375 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.56 HG21 ' O ' ' A' ' 462' ' ' GLU . 14.7 t -160.4 146.89 15.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.012 0.434 . . . . 0.0 110.496 178.963 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.693 ' HB3' ' O ' ' A' ' 447' ' ' LYS . 20.6 t -97.48 121.25 39.16 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.711 -176.748 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -133.56 141.85 47.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.792 0.33 . . . . 0.0 111.576 -175.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.519 -0.753 . . . . 0.0 109.718 175.036 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.847 0 N-CA-C 112.182 -0.367 . . . . 0.0 112.182 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 4.8 m -81.73 53.81 2.24 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.358 0.599 . . . . 0.0 110.519 179.111 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -73.03 -46.04 54.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.517 -178.262 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -84.31 140.24 31.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.082 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 6.9 p -126.88 -84.63 0.61 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.127 177.4 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp 55.55 61.16 2.96 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.438 0.637 . . . . 0.0 110.361 176.083 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 12.3 p -69.39 -20.48 63.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.771 -175.613 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -63.1 171.46 12.54 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.053 -0.594 . . . . 0.0 112.341 179.287 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 46.0 t -67.36 126.07 92.01 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 178.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -63.24 147.48 93.84 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.679 2.252 . . . . 0.0 112.494 -178.174 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 15.7 t -77.85 59.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.467 0.651 . . . . 0.0 110.04 178.186 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 8.8 m -70.86 -28.7 64.77 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.204 -175.615 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.541 ' O ' HG22 ' A' ' 434' ' ' THR . 25.2 pt20 47.36 -135.62 0.95 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.716 0.806 . . . . 0.0 110.833 -175.874 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 434' ' ' THR . . . . . 0.541 HG22 ' O ' ' A' ' 433' ' ' GLN . 6.2 t 46.61 39.07 6.38 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.593 0.757 . . . . 0.0 111.485 179.149 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -74.54 -45.27 46.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.583 178.097 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 58.2 m -64.84 -51.42 62.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.64 -177.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -170.13 143.32 2.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.812 0.339 . . . . 0.0 111.367 -179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -171.37 130.09 1.9 Allowed Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.811 178.654 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 58.59 42.96 19.82 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.136 0.493 . . . . 0.0 111.051 -178.106 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -76.32 159.35 30.63 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.917 179.469 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 17.9 m -54.55 122.97 11.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.494 -176.772 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.435 HG21 ' N ' ' A' ' 446' ' ' CYS . 15.4 t -175.88 -24.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.868 -178.595 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 75.96 131.46 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.517 0.727 . . . . 0.0 110.666 -174.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 1.027 ' HG2' ' HB2' ' A' ' 467' ' ' LYS . 1.2 tp10 57.94 27.07 14.19 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.337 -176.248 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.702 ' HE2' ' HB2' ' A' ' 468' ' ' ASP . 16.3 ttpt 51.15 21.33 1.04 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.426 176.894 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.474 ' SG ' ' HD2' ' A' ' 449' ' ' LYS . 0.5 OUTLIER -172.32 -26.21 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -174.356 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -55.1 113.0 1.19 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.909 0.385 . . . . 0.0 110.982 -174.713 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.83 -30.86 3.03 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.295 -174.51 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.474 ' HD2' ' SG ' ' A' ' 446' ' ' CYS . 96.0 mttt -63.93 140.41 58.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.733 -0.233 . . . . 0.0 110.996 178.429 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.52 172.67 47.89 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 171.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.82 -41.73 78.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.277 0.539 . . . . 0.0 111.101 -178.594 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -71.57 -41.75 68.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.487 -178.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.62 -35.57 80.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.293 0.568 . . . . 0.0 110.451 177.008 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 15.9 t -68.37 109.16 3.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.522 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -85.18 126.92 34.04 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.524 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -59.4 -49.58 91.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -175.725 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.4 Cg_endo -61.0 -33.21 92.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.716 1.611 . . . . 0.0 111.67 178.659 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -78.04 -45.39 23.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.505 -179.681 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.426 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 57.6 m -146.87 143.14 28.34 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 -178.901 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.49 ' O ' ' HD3' ' A' ' 467' ' ' LYS . 16.4 ptpt -86.41 135.54 33.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.205 0.526 . . . . 0.0 110.798 178.237 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 77.2 t-105 -95.28 121.14 36.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.52 -175.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.762 ' HB2' ' HZ3' ' A' ' 467' ' ' LYS . 18.1 tt0 -81.52 -135.72 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.485 178.56 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.81 -43.1 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.317 177.1 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.28 44.68 0.55 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.549 -0.621 . . . . 0.0 111.549 179.542 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.404 ' O ' HG22 ' A' ' 465' ' ' THR . 14.6 t -162.29 136.19 6.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.368 0.604 . . . . 0.0 110.554 178.684 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 35.5 t -96.29 134.9 38.84 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.47 -0.786 . . . . 0.0 108.943 178.415 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 1.027 ' HB2' ' HG2' ' A' ' 444' ' ' GLU . 0.0 OUTLIER -153.0 135.07 14.8 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.911 -0.716 . . . . 0.0 111.715 -178.113 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.702 ' HB2' ' HE2' ' A' ' 445' ' ' LYS . 23.2 t70 . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.486 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.712 0 N-CA-C 112.115 -0.394 . . . . 0.0 112.115 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 69.9 m -69.52 126.16 28.9 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.61 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm 69.48 133.31 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.91 0.756 . . . . 0.0 110.778 -174.746 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -60.42 -49.69 76.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.404 179.422 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 36.5 p 44.85 48.25 9.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.102 176.455 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -173.36 -45.51 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.474 178.605 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 15.0 m -74.55 115.5 14.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.016 -179.312 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . 0.708 ' O ' HG23 ' A' ' 429' ' ' VAL . . . 74.75 -60.26 2.53 Favored Glycine 0 CA--C 1.52 0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 113.494 177.092 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 428' ' ' GLY . 5.9 m 55.9 135.53 0.02 OUTLIER Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 125.373 1.469 . . . . 0.0 113.512 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 2.9 Cg_exo -76.21 35.2 0.45 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 123.195 2.597 . . . . 0.0 112.664 -178.974 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 52.1 t -94.58 114.8 31.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.242 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 9.9 t -167.06 138.81 3.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.35 -175.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -143.55 36.27 1.32 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.139 0.495 . . . . 0.0 110.327 -179.458 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 2.3 p -77.68 50.78 0.86 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.484 177.459 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -134.07 -49.61 0.81 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 176.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 9.5 p -79.94 -50.4 10.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.471 170.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -84.45 131.58 34.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.868 173.103 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -171.17 39.94 0.18 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.395 -0.907 . . . . 0.0 112.342 -178.492 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 68.78 142.66 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.609 0.719 . . . . 0.0 112.058 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 39.4 p30 -82.6 27.97 0.49 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.155 -177.297 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.2 m -94.51 -54.66 3.43 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 173.434 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.779 HG23 ' HA ' ' A' ' 445' ' ' LYS . 7.3 m -100.35 52.83 0.89 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.288 174.094 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -62.24 -56.08 22.1 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.545 -174.601 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.5 25.84 5.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.363 0.602 . . . . 0.0 110.494 177.92 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.779 ' HA ' HG23 ' A' ' 442' ' ' THR . 29.3 mtpp 53.1 31.74 11.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.466 -1.243 . . . . 0.0 112.363 177.674 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.553 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 2.4 t 66.31 7.49 4.95 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.488 0.715 . . . . 0.0 110.86 175.643 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 62.0 tttp -75.76 128.17 34.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.176 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 133.22 -37.93 1.93 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.281 179.3 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.271 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.33 179.42 25.08 Favored Glycine 0 C--O 1.226 -0.359 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.7 175.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.98 -43.75 94.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.219 0.51 . . . . 0.0 111.558 -176.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.93 -40.47 91.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.044 0.45 . . . . 0.0 110.354 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -69.95 -41.01 75.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.912 -179.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.5 114.12 2.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.098 -177.355 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 49.8 mtmt -72.6 117.23 14.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 176.048 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.499 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.7 t -64.59 -50.35 65.68 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -173.883 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 456' ' ' SER . 29.6 Cg_endo -61.47 -29.81 85.68 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.632 1.555 . . . . 0.0 111.649 178.514 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 1.0 OUTLIER -85.35 -40.91 15.97 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.221 -176.032 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.49 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 9.2 m -137.88 144.66 41.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.678 0.275 . . . . 0.0 110.452 -174.629 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . 0.429 ' HD2' ' N ' ' A' ' 460' ' ' LYS . 4.4 mptp? -80.9 148.02 30.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.089 0.471 . . . . 0.0 110.532 178.67 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -107.43 123.02 47.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.454 178.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.477 ' HG2' ' H ' ' A' ' 463' ' ' GLY . 22.9 tt0 -85.33 -136.67 0.06 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 177.268 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . 0.477 ' H ' ' HG2' ' A' ' 462' ' ' GLU . . . -73.88 -42.76 36.93 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 110.904 -0.879 . . . . 0.0 110.904 175.132 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.99 42.59 0.48 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 177.456 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 91.2 m -148.47 129.19 14.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.811 0.339 . . . . 0.0 110.943 -176.96 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.553 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 8.7 t -83.6 135.79 34.48 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.139 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.72 ' HA ' ' O ' ' A' ' 445' ' ' LYS . 60.5 pttt -159.78 134.89 8.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.467 0.651 . . . . 0.0 111.887 -179.659 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.684 178.12 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.613 0 N-CA-C 111.731 -0.548 . . . . 0.0 111.731 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 17.0 m 56.41 44.69 24.02 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.67 0.748 . . . . 0.0 110.964 178.812 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -166.14 35.66 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.194 177.682 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -165.29 129.54 2.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.179 178.619 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 43.6 m -151.71 -37.78 0.12 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.995 0.426 . . . . 0.0 110.328 -177.886 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -150.93 -136.57 0.07 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.833 178.966 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 10.0 t 62.33 44.87 7.08 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.425 0.631 . . . . 0.0 109.958 179.999 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 177.15 136.13 2.36 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.501 -178.779 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.437 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 11.5 p -136.51 130.22 17.91 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-O 120.751 0.31 . . . . 0.0 110.237 -178.6 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 52.1 Cg_exo -57.3 -35.39 98.88 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.964 2.443 . . . . 0.0 112.742 -175.933 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.791 ' HA ' ' HG2' ' A' ' 435' ' ' GLN . 27.5 m -84.43 38.16 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-O 121.129 0.49 . . . . 0.0 111.377 179.193 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 14.6 t -69.47 143.42 53.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.668 178.72 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 94.2 mm-40 63.6 40.58 7.91 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.998 -176.238 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 1.4 m 58.32 26.31 13.83 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.394 -178.16 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . 0.791 ' HG2' ' HA ' ' A' ' 431' ' ' VAL . 0.5 OUTLIER 64.73 124.6 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.391 -176.614 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 8.8 t -161.23 38.21 0.14 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.579 0.704 . . . . 0.0 109.847 178.777 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -158.81 33.89 0.22 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.231 177.525 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -73.02 -42.88 42.76 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.044 179.743 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -155.45 138.08 15.13 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 177.975 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . 0.473 ' C ' ' HG1' ' A' ' 441' ' ' THR . 66.3 m-20 -61.44 132.27 52.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.419 -178.459 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.473 ' HG1' ' C ' ' A' ' 440' ' ' ASP . 17.1 p 50.53 39.54 21.32 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.344 0.658 . . . . 0.0 112.03 -179.147 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 90.9 m 70.28 -52.7 0.65 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.422 0.689 . . . . 0.0 112.266 178.742 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 55.25 -141.21 0.87 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -176.514 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -103.73 33.16 3.51 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.777 175.57 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 44.0 tttp -71.25 -36.5 71.79 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.717 171.633 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 63.8 m -123.24 -32.89 3.37 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.592 178.37 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -71.85 125.67 27.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 110.595 -177.004 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 130.08 -29.57 3.68 Favored Glycine 0 N--CA 1.441 -0.971 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.315 -178.803 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.527 ' HB2' ' CB ' ' A' ' 453' ' ' ASP . 9.8 pttm -97.45 139.11 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.638 178.942 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.22 -168.88 14.54 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.418 -174.76 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.32 -40.87 90.2 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 122.658 0.383 . . . . 0.0 111.484 -176.785 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.528 ' HB3' ' HZ1' ' A' ' 452' ' ' LYS . 2.8 mmmp? -62.5 -41.52 98.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.154 0.502 . . . . 0.0 110.119 178.071 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.527 ' CB ' ' HB2' ' A' ' 449' ' ' LYS . 90.6 m-20 -73.73 -41.61 62.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.528 -179.411 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 7.8 t -63.41 118.76 8.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.84 -176.038 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -156.65 172.97 17.64 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.545 -178.779 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.458 ' C ' ' H ' ' A' ' 458' ' ' ASP . 5.9 t 68.58 147.61 0.11 Allowed Pre-proline 0 C--O 1.226 -0.159 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.178 175.11 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.433 ' HD2' ' OG ' ' A' ' 456' ' ' SER . 27.3 Cg_endo -61.64 -1.56 2.11 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.507 2.138 . . . . 0.0 111.748 177.684 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.458 ' H ' ' C ' ' A' ' 456' ' ' SER . 3.0 m-20 -72.35 -37.28 68.88 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.1 174.949 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.473 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 79.8 m -135.64 131.86 36.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.367 177.081 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -105.96 133.39 50.75 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.979 -177.818 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -85.82 132.68 34.06 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 174.689 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -157.31 128.98 6.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.056 -0.257 . . . . 0.0 111.01 -178.132 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.54 -70.59 0.37 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.015 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -175.57 31.69 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 177.471 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.1 m -151.23 134.85 16.32 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -177.014 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 17.0 t -84.97 125.82 33.01 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.049 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 446' ' ' CYS . 22.5 pttp -156.79 144.01 18.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.671 0.272 . . . . 0.0 111.065 -176.247 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.887 -176.987 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.945 0 N-CA-C 111.762 -0.535 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 21.9 p -82.34 -140.55 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.654 0.264 . . . . 0.0 111.2 178.917 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -157.63 -54.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.871 0.367 . . . . 0.0 110.235 179.417 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -88.62 -43.9 11.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.861 176.724 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 13.2 m 67.71 128.76 0.02 OUTLIER 'General case' 0 C--O 1.235 0.317 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.275 179.892 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 3.2 pptp? -73.56 -26.07 60.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.307 178.985 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 23.5 m 59.73 86.66 0.09 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.654 175.148 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -178.44 127.46 1.16 Allowed Glycine 0 N--CA 1.442 -0.917 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.618 178.121 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.418 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 15.6 m -62.34 137.66 96.1 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-O 120.817 0.341 . . . . 0.0 110.848 -178.9 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 24.3 Cg_exo -65.59 142.9 72.99 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.676 2.25 . . . . 0.0 112.064 -177.609 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.473 HG11 ' HG2' ' A' ' 433' ' ' GLN . 20.3 t -77.75 67.01 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.327 0.584 . . . . 0.0 109.633 177.228 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 5.5 p -73.55 59.64 0.63 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.013 -174.707 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.473 ' HG2' HG11 ' A' ' 431' ' ' VAL . 18.5 pt20 -144.03 -45.67 0.26 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.86 177.402 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 8.6 t -87.16 132.43 33.86 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 171.764 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -171.13 124.65 0.63 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.591 -176.184 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 14.2 t 40.35 47.83 2.26 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.422 1.089 . . . . 0.0 112.487 179.075 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 70.96 -48.4 0.67 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.916 0.886 . . . . 0.0 112.611 177.504 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 69.99 -140.61 33.09 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.978 -179.451 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 52.45 54.5 10.56 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.842 0.353 . . . . 0.0 111.699 177.783 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -71.15 -50.35 34.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.975 0.417 . . . . 0.0 111.254 -176.963 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 6.9 m -77.26 -54.4 6.53 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.187 -176.754 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 442' ' ' THR . . . . . 0.487 ' O ' HG22 ' A' ' 442' ' ' THR . 15.2 t -85.19 130.05 34.68 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.896 0.379 . . . . 0.0 110.508 178.432 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -82.93 39.45 0.63 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.919 0.39 . . . . 0.0 110.639 179.106 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.906 ' HG3' ' HB3' ' A' ' 447' ' ' LYS . 30.9 tt0 54.81 43.5 29.94 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.703 0.763 . . . . 0.0 110.605 -178.438 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -64.21 -38.93 92.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.411 176.55 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.785 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 73.2 m -122.56 -11.03 8.32 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 113.98 -1.464 . . . . 0.0 112.642 -166.315 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.906 ' HB3' ' HG3' ' A' ' 444' ' ' GLU . 85.2 tttt -67.42 105.67 1.87 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.104 179.872 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 137.52 -28.19 2.79 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.213 -179.643 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -86.6 154.34 21.12 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.416 -176.902 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.57 177.44 30.06 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.83 -176.253 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.01 -50.74 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.844 -0.209 . . . . 0.0 110.973 -177.9 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -68.18 -31.07 70.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.936 0.398 . . . . 0.0 110.535 179.55 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.55 -34.73 72.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.02 178.571 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 48.9 t -60.12 116.76 4.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.23 179.842 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.453 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 35.9 mtmm -81.04 124.78 29.46 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.709 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 9.6 m -62.93 -54.08 49.92 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -172.418 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.5 Cg_endo -62.08 -28.37 80.05 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.475 1.45 . . . . 0.0 111.235 178.976 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.453 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 45.3 t0 -75.03 -50.96 14.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.972 178.089 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.48 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 98.2 m -148.54 148.39 30.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.404 0.621 . . . . 0.0 111.509 -175.169 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -92.35 139.58 30.45 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.282 177.241 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 48.9 t-105 -77.2 119.78 21.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.158 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -149.3 130.42 14.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.84 0.352 . . . . 0.0 110.454 -176.587 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.75 38.27 91.66 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.377 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.95 84.01 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.258 -0.496 . . . . 0.0 112.313 -177.815 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 85.9 m -150.82 135.84 17.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.695 0.283 . . . . 0.0 110.287 -177.002 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.785 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 20.0 t -78.63 124.94 28.7 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -161.39 134.28 6.21 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.137 0.494 . . . . 0.0 111.39 -174.907 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . 0.419 ' HB3' ' HA ' ' A' ' 459' ' ' CYS . 29.4 p-10 . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.642 177.91 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.714 0 N-CA-C 112.191 -0.364 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 6.6 m -67.99 129.73 40.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.595 0.236 . . . . 0.0 110.388 -179.704 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.07 35.3 0.14 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.927 -177.198 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 69.6 145.93 0.06 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.403 -179.356 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.7 m -57.08 139.15 53.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.893 -178.152 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -54.08 124.68 16.34 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.203 -177.466 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 51.0 m -160.36 129.33 4.9 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.16 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -152.21 36.34 0.82 Allowed Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.084 -177.521 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 7.3 p -177.12 126.9 0.3 Allowed Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 177.067 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 18.4 Cg_exo -68.52 -34.87 18.89 Favored 'Trans proline' 0 C--O 1.234 0.301 0 C-N-CA 122.772 2.314 . . . . 0.0 111.535 -177.625 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 14.2 t 64.48 47.9 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.634 -176.876 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 23.5 m -69.29 -39.42 78.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.492 177.264 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.2 tm0? -134.58 118.59 17.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.056 -0.975 . . . . 0.0 108.433 174.174 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 12.3 m -63.95 116.85 6.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.606 -176.093 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . 0.421 ' C ' ' H ' ' A' ' 437' ' ' ALA . 4.2 tp-100 -54.74 -49.63 70.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.858 -177.434 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 7.9 m 72.56 -38.72 0.43 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 122.864 0.466 . . . . 0.0 112.059 177.097 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . 0.487 ' HB1' ' H ' ' A' ' 438' ' ' GLY . . . 61.16 -139.01 0.54 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.982 0.513 . . . . 0.0 111.285 178.635 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . 0.487 ' H ' ' HB1' ' A' ' 437' ' ' ALA . . . 84.18 140.23 4.48 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.988 -177.686 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -156.52 134.13 10.87 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 -179.757 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 60.68 40.55 16.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.837 -176.594 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 2.7 m -75.24 -43.14 53.26 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.422 0.63 . . . . 0.0 109.552 176.79 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 12.9 m -158.27 125.34 4.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.337 179.47 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -64.86 -37.81 88.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.032 0.444 . . . . 0.0 110.451 -179.572 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.433 ' HG2' ' HB3' ' A' ' 447' ' ' LYS . 86.1 mt-10 63.36 42.64 6.68 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.002 -0.999 . . . . 0.0 112.448 175.726 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -79.37 -34.75 41.71 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 170.065 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.865 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 81.9 m -97.82 -44.42 6.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.425 174.174 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 1.1 tmtp? -52.76 127.41 23.18 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.543 -178.795 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 108.89 -28.57 11.03 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.606 -178.868 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.865 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 57.0 mtmt -72.28 144.68 48.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.793 0.296 . . . . 0.0 111.132 -178.888 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.84 175.25 34.92 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 175.935 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.52 -37.09 74.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 117.346 0.573 . . . . 0.0 111.459 -177.253 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -68.6 -41.67 79.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.234 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.605 ' HB3' ' HD2' ' A' ' 449' ' ' LYS . 1.1 m-20 -75.96 -36.87 59.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 110.56 178.852 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.48 ' SG ' ' N ' ' A' ' 455' ' ' LYS . 36.9 t -77.55 -157.73 0.1 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.351 179.589 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 454' ' ' CYS . 27.7 mmmt 61.36 49.67 5.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.862 0.839 . . . . 0.0 110.749 -175.282 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.516 ' C ' ' H ' ' A' ' 458' ' ' ASP . 0.9 OUTLIER -71.77 171.72 8.59 Favored Pre-proline 0 C--N 1.31 -1.127 0 CA-C-N 114.438 -1.255 . . . . 0.0 108.974 176.06 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.57 29.07 0.43 Allowed 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.102 1.868 . . . . 0.0 111.097 175.949 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . 0.516 ' H ' ' C ' ' A' ' 456' ' ' SER . 49.6 t0 -158.52 -49.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.489 -179.121 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 69.3 m -79.34 137.54 37.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.991 -179.484 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -115.22 160.48 19.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.306 0.574 . . . . 0.0 111.594 -178.563 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.439 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 37.1 t-105 -91.46 136.27 33.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.79 179.202 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 465' ' ' THR . 36.8 tt0 -128.24 75.38 1.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.944 0.402 . . . . 0.0 111.691 -177.59 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 60.78 57.96 16.19 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.756 175.383 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 78.99 40.79 15.69 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.947 178.762 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 462' ' ' GLU . 6.3 t -166.87 143.12 4.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 175.334 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 36.6 t -98.91 139.73 34.13 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.576 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.426 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 21.9 pttp -153.54 152.13 30.58 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.993 0.425 . . . . 0.0 111.103 -178.363 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.337 175.251 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . 0.431 ' C ' ' HG1' ' A' ' 422' ' ' THR . . . . . . . . 0 N--CA 1.482 1.751 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 . . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 422' ' ' THR . . . . . 0.431 ' HG1' ' C ' ' A' ' 421' ' ' GLY . 52.7 p 54.06 115.02 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.245 1.018 . . . . 0.0 112.731 178.317 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -67.63 137.36 55.55 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.118 177.725 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -61.28 126.93 29.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.117 -176.606 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 10.9 t 56.72 50.48 12.53 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.692 -179.362 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -153.14 139.26 18.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.369 -179.244 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 13.0 m -65.49 137.66 57.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.605 -176.792 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -174.33 -148.1 6.4 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.828 178.845 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 25.4 t -123.9 104.07 33.3 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-O 120.805 0.336 . . . . 0.0 110.575 179.488 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -69.29 -43.67 2.9 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.927 2.418 . . . . 0.0 112.023 -179.036 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 22.1 m -71.16 143.63 14.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.411 -179.856 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 42.3 m -72.9 -40.12 65.81 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.665 179.062 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -67.34 135.03 52.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.906 178.44 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 14.6 m -79.67 74.79 6.35 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.461 178.549 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 95.0 mm-40 62.21 -130.22 0.62 Allowed 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.765 -176.809 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 13.2 p -81.84 -17.87 45.93 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.417 179.515 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . 0.46 ' HB3' ' H ' ' A' ' 438' ' ' GLY . . . 63.45 -143.29 0.34 Allowed 'General case' 0 C--O 1.231 0.103 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.752 -177.478 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . 0.46 ' H ' ' HB3' ' A' ' 437' ' ' ALA . . . -70.34 134.5 24.75 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.288 179.633 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . 0.462 ' HB1' ' HA ' ' A' ' 443' ' ' ALA . . . -161.77 128.5 3.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.632 0.253 . . . . 0.0 110.944 -179.812 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -72.18 -41.67 66.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.809 0.814 . . . . 0.0 109.827 177.804 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 54.1 m -165.51 -41.55 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.338 -1.301 . . . . 0.0 107.686 -179.963 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.3 126.33 35.82 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.847 172.215 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . 0.462 ' HA ' ' HB1' ' A' ' 439' ' ' ALA . . . -61.38 -41.39 97.03 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.32 0.581 . . . . 0.0 110.433 -179.61 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.433 ' HG3' ' HB2' ' A' ' 447' ' ' LYS . 8.0 pt-20 -59.98 108.37 0.76 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.687 179.629 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 17.1 mtmm -75.91 49.0 0.51 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.455 177.572 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.742 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 59.0 m -141.85 -23.78 0.7 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.069 -177.385 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.433 ' HB2' ' HG3' ' A' ' 444' ' ' GLU . 22.7 tptp -56.01 107.71 0.38 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.31 -173.65 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 78.32 56.07 3.8 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.673 -0.694 . . . . 0.0 113.875 177.297 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 446' ' ' CYS . 14.5 ptpt -129.57 166.79 19.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.219 0.51 . . . . 0.0 110.692 173.451 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 165.11 54.68 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.086 -177.781 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.45 -35.11 78.57 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.318 0.247 . . . . 0.0 111.104 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 39.25 0.71 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.643 0.735 . . . . 0.0 110.388 176.694 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -156.28 -44.51 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.576 -178.566 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.48 129.46 39.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.039 176.507 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . 0.443 ' HZ3' ' HB2' ' A' ' 455' ' ' LYS . 8.8 mtmp? -106.73 117.76 34.91 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.325 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 26.1 t -56.95 -48.43 97.43 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -173.601 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.2 Cg_endo -58.01 -30.13 89.05 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.625 1.55 . . . . 0.0 112.187 -179.227 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -87.95 -45.08 10.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.156 -179.842 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 456' ' ' SER . 68.4 m -143.13 142.08 31.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.947 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -89.05 147.23 24.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.731 0.777 . . . . 0.0 112.008 -175.265 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -94.82 119.52 33.54 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.345 179.615 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -146.07 129.89 17.2 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.572 0.225 . . . . 0.0 110.756 -179.161 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.67 42.68 96.37 Favored Glycine 0 N--CA 1.454 -0.152 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.221 -178.929 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 57.18 34.71 67.52 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.061 -177.025 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 32.7 m -143.93 130.72 20.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.715 0.293 . . . . 0.0 110.874 -175.038 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.742 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.1 t -88.64 134.61 33.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.98 178.654 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -172.53 154.34 3.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 111.229 -179.448 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 7.6 t70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.306 -0.854 . . . . 0.0 109.478 175.057 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.534 -0.627 . . . . 0.0 111.534 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 422' ' ' THR . . . . . 0.439 ' HB ' ' H ' ' A' ' 423' ' ' LYS . 6.7 p -86.45 -142.94 0.1 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.771 0.286 . . . . 0.0 111.227 -179.628 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 423' ' ' LYS . . . . . 0.439 ' H ' ' HB ' ' A' ' 422' ' ' THR . 68.3 mttm 70.3 138.93 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.337 0.655 . . . . 0.0 111.29 -178.526 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -73.19 -20.14 60.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.886 -179.834 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 5.4 p -76.09 37.97 0.16 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -177.296 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -93.74 129.46 40.07 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 174.954 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.4 t -89.81 117.2 28.48 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.136 -179.952 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -77.17 -47.09 9.48 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.163 176.662 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . 0.45 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 62.1 t -75.88 132.32 74.65 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.347 -0.426 . . . . 0.0 110.178 175.528 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 430' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 8.1 Cg_exo -71.55 62.67 2.91 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 123.217 2.612 . . . . 0.0 111.913 178.896 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . 0.501 ' HA ' HG22 ' A' ' 436' ' ' THR . 15.4 m -72.74 48.69 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-O 121.185 0.516 . . . . 0.0 112.125 -176.823 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 8.9 t -77.25 135.93 38.49 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.124 176.494 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 70.95 144.25 0.06 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.268 -177.257 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 2.8 p -76.42 51.8 0.74 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.583 179.856 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -164.15 33.04 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.286 0.565 . . . . 0.0 110.345 -176.793 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 436' ' ' THR . . . . . 0.501 HG22 ' HA ' ' A' ' 431' ' ' VAL . 1.6 m -81.38 126.64 31.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.452 178.402 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -166.38 -39.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.638 0.256 . . . . 0.0 111.23 -179.675 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 68.41 44.69 72.58 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 -175.865 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -150.29 -45.67 0.13 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.823 0.344 . . . . 0.0 110.942 -176.614 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -75.0 118.99 18.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.757 179.771 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -32.93 74.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.85 177.777 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 3.6 t -147.36 131.0 16.86 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.481 177.209 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -82.75 47.16 1.16 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.138 -178.59 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.814 ' HG3' ' HB3' ' A' ' 447' ' ' LYS . 31.8 tt0 55.88 46.39 22.21 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 121.636 0.732 . . . . 0.0 111.043 179.332 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -34.02 53.51 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.455 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.77 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 70.8 m -110.72 -28.19 8.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.05 179.595 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.814 ' HB3' ' HG3' ' A' ' 444' ' ' GLU . 9.1 tmtm? -61.58 130.87 48.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -173.323 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.5 17.01 79.81 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.52 -0.763 . . . . 0.0 114.4 175.187 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 449' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 50.8 mtmt -93.19 137.94 32.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 117.972 0.886 . . . . 0.0 110.327 173.868 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.47 166.18 51.29 Favored Glycine 0 C--O 1.223 -0.538 0 C-N-CA 121.018 -0.611 . . . . 0.0 111.854 178.622 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . 0.431 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 37.1 tt0 -59.26 -34.71 72.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.033 0.444 . . . . 0.0 111.635 -177.218 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -69.67 -44.38 70.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.803 0.335 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.54 -44.35 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.603 -179.015 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 454' ' ' CYS . . . . . 0.531 ' SG ' ' HE3' ' A' ' 449' ' ' LYS . 0.3 OUTLIER -80.29 115.9 20.08 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.305 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -87.95 148.05 24.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 178.773 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 456' ' ' SER . . . . . 0.484 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -62.96 -51.75 68.69 Favored Pre-proline 0 C--N 1.322 -0.606 0 O-C-N 123.347 0.404 . . . . 0.0 111.605 -179.845 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 457' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.1 Cg_endo -61.81 -30.98 85.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.599 1.533 . . . . 0.0 111.46 176.584 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -71.71 -47.99 50.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.008 178.357 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 63.4 m -148.55 143.12 26.42 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.157 -173.584 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.02 124.28 23.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.956 0.408 . . . . 0.0 110.781 -178.303 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 461' ' ' TRP . . . . . 0.592 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 60.3 t-105 -107.08 126.56 52.51 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.685 178.339 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 462' ' ' GLU . . . . . 0.871 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 21.3 tt0 -90.61 -60.5 1.9 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.975 0.417 . . . . 0.0 110.133 -179.176 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 176.55 40.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 178.286 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 147.55 -41.78 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -176.215 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.6 m -104.84 134.17 48.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.469 -0.365 . . . . 0.0 111.311 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 466' ' ' CYS . . . . . 0.592 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 1.8 t -101.09 145.1 29.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.971 178.666 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 467' ' ' LYS . . . . . 0.871 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 0.5 OUTLIER -148.16 140.17 24.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.123 0.487 . . . . 0.0 111.53 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 5.9 t70 . . . . . 0 C--O 1.251 1.158 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.507 179.676 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.419 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 57.0 m . . . . . 0 N--CA 1.451 -0.417 0 CA-C-O 121.428 0.633 . . . . 0.0 109.786 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 14.3 tptm -60.73 118.15 6.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.598 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.52 -25.87 8.88 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.146 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.596 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 68.4 mttm -69.33 144.02 53.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.61 0.243 . . . . 0.0 111.565 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -77.79 176.12 53.98 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 171.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -56.31 -44.34 79.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.858 0.329 . . . . 0.0 111.24 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -64.91 -40.63 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 47.2 m-20 -69.33 -43.62 73.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.711 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 8.7 t -60.93 111.32 1.62 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.733 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.661 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 95.0 mttt -82.95 127.03 33.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.554 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 69.8 m -61.39 -49.0 89.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -58.37 -28.3 84.45 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 121.796 1.664 . . . . 0.0 111.96 177.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.661 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 0.7 OUTLIER -86.87 -45.67 10.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.991 -178.219 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.1 m -140.77 146.63 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.73 -172.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.499 ' HG3' ' HG3' ' A' ' 462' ' ' GLU . 24.7 tptp -88.7 112.9 23.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.478 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -83.87 106.92 15.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.504 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 51.4 mt-10 -138.42 132.33 31.22 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.154 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.19 41.39 99.47 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.685 -0.688 . . . . 0.0 112.836 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.06 36.29 92.09 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.319 -0.467 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 89.1 m -149.97 129.23 12.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.787 0.327 . . . . 0.0 110.511 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 22.8 t -87.53 126.51 34.96 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.504 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 52.1 pttt -151.4 142.57 23.22 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.569 0.699 . . . . 0.0 112.146 -174.429 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 C--O 1.247 0.972 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.446 175.791 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.686 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 42.5 m . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 121.31 0.576 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -53.0 128.46 27.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.266 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 100.33 -22.76 38.59 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.023 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -71.04 137.46 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.959 0.409 . . . . 0.0 112.097 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.22 176.75 49.5 Favored Glycine 0 N--CA 1.444 -0.788 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 171.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -63.89 -43.4 96.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 117.193 0.497 . . . . 0.0 110.413 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 452' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 10.2 mptt -82.45 37.5 0.51 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.368 0.604 . . . . 0.0 111.016 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.73 -41.66 0.1 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.6 t -54.68 108.52 0.4 Allowed 'General case' 0 C--O 1.237 0.406 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.463 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.473 ' HB3' ' HB2' ' A' ' 458' ' ' ASP . 0.3 OUTLIER -71.11 126.97 31.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.108 178.44 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.524 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.6 m -67.55 -46.99 47.44 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.838 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 456' ' ' SER . 24.8 Cg_endo -61.83 -36.21 74.44 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.187 1.258 . . . . 0.0 111.772 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.473 ' HB2' ' HB3' ' A' ' 455' ' ' LYS . 9.3 m-20 -79.47 -39.82 31.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.177 -178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 10.3 m -133.35 -148.63 0.34 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.962 -171.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.537 ' HG3' ' HB2' ' A' ' 467' ' ' LYS . 9.9 ptpp? -167.51 149.13 5.63 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -97.94 133.19 42.76 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.506 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -139.86 122.69 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.41 -92.66 0.13 Allowed Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 -176.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -147.62 36.07 1.18 Allowed Glycine 0 N--CA 1.439 -1.147 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 1.9 p -140.62 144.15 35.59 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.293 0.568 . . . . 0.0 112.332 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.686 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 19.6 t -81.7 109.48 16.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.72 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.657 ' HE2' ' HA ' ' A' ' 467' ' ' LYS . 10.5 mmpt? -85.96 139.16 31.44 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.559 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.251 176.741 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.454 -0.27 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.3 tttm -61.43 105.24 0.49 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.592 173.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 136.74 -32.88 2.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.912 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 9.9 mmmm -65.76 142.45 57.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.273 . . . . 0.0 110.292 177.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.73 -176.85 22.46 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.141 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.53 -45.21 94.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.899 0.349 . . . . 0.0 111.19 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -71.29 -42.08 69.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 110.557 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.912 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.8 OUTLIER -65.03 -31.42 72.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.369 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.416 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 9.7 t -70.42 89.18 0.68 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.21 0.528 . . . . 0.0 109.736 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.418 ' HB3' ' HD2' ' A' ' 457' ' ' PRO . 97.2 mttt -83.97 147.4 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.189 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.476 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 15.4 m -60.77 -48.57 92.64 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 17.4 Cg_exo -64.66 -27.2 60.8 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.583 1.522 . . . . 0.0 111.487 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -82.47 -40.97 20.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.515 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.471 ' SG ' ' N ' ' A' ' 460' ' ' LYS . 22.1 t -162.99 -151.54 0.19 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.263 0.554 . . . . 0.0 111.103 -171.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.471 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 42.4 mmtm -147.2 127.67 14.07 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.577 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.416 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 67.0 t-105 -88.69 118.44 28.37 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -75.62 -72.21 0.33 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -178.2 41.09 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 155.32 -33.03 0.65 Allowed Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -176.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 28.0 m -132.46 136.89 47.01 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 120.874 0.369 . . . . 0.0 110.545 -179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 8.2 t -75.28 144.24 42.6 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.258 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -177.27 126.97 0.15 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.387 0.613 . . . . 0.0 111.229 -176.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.572 -178.321 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 454' ' ' CYS . 17.4 m . . . . . 0 N--CA 1.453 -0.321 0 CA-C-O 120.212 0.053 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -58.6 117.36 4.45 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 121.03 -28.99 5.91 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.969 -175.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -73.1 146.5 45.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.683 0.277 . . . . 0.0 111.339 -179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -81.76 173.72 53.81 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.59 173.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -63.6 -33.16 75.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -83.12 35.47 0.49 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.257 0.551 . . . . 0.0 111.269 177.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -160.08 -50.92 0.05 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.631 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.5 OUTLIER -72.46 120.6 18.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.027 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.495 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 16.4 ptpt -75.39 122.03 23.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.314 178.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 456' ' ' SER . . . . . . . . . . . . . 21.1 m -69.57 -44.78 25.42 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -173.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.22 -40.61 81.38 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.179 1.253 . . . . 0.0 111.531 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.495 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 27.5 t70 -80.68 -43.46 20.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.753 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 88.3 m -121.6 133.88 55.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.164 0.507 . . . . 0.0 111.233 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.673 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 46.4 mttt -64.73 138.57 58.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.096 -176.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.45 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 61.3 t-105 -119.31 129.44 54.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.317 175.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -170.15 131.97 1.03 Allowed 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.214 0.321 . . . . 0.0 110.717 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 63.34 36.82 93.91 Favored Glycine 0 CA--C 1.517 0.192 0 CA-C-N 116.173 -0.467 . . . . 0.0 113.256 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.14 39.76 97.59 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.768 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.4 t -161.77 139.92 9.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.45 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 1.6 t -91.79 144.12 25.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.185 -176.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.673 ' HG2' ' HB2' ' A' ' 460' ' ' LYS . 0.0 OUTLIER -149.42 146.86 27.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.647 0.26 . . . . 0.0 110.811 -178.129 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 50.1 t0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.688 -0.672 . . . . 0.0 109.593 179.501 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.713 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 90.1 m . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -52.78 115.35 1.78 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.787 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 122.4 -28.48 5.76 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.587 -176.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.697 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 22.5 mtmm -80.41 138.26 36.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.578 0.227 . . . . 0.0 111.474 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -76.64 -169.79 30.69 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -62.67 -46.04 90.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.95 0.375 . . . . 0.0 111.539 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -64.3 -34.19 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 111.045 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.2 -40.32 27.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.876 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 14.7 t -58.65 114.09 2.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.958 -177.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.845 ' HE3' ' HA ' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -87.51 125.39 34.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.019 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.543 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 m -60.8 -49.03 91.24 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.6 Cg_endo -60.11 -26.74 83.3 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.022 1.815 . . . . 0.0 112.078 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -87.85 -45.34 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.924 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 68.9 m -146.27 152.65 39.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.271 0.558 . . . . 0.0 111.63 -176.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.1 131.84 35.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.3 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -78.71 113.55 16.87 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -74.58 -47.26 33.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.006 0.431 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.71 -46.47 0.18 Allowed Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.226 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -140.07 31.53 2.26 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 177.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.7 t -170.94 145.31 2.32 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.026 0.441 . . . . 0.0 110.242 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.713 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 12.3 t -87.7 132.23 34.19 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.42 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 0.0 OUTLIER -158.29 153.19 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.838 -171.954 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.887 179.455 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.513 ' SG ' ' HE2' ' A' ' 449' ' ' LYS . 3.6 t . . . . . 0 CA--C 1.534 0.338 0 CA-C-O 120.91 0.386 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 466' ' ' CYS . 55.0 tttm -59.37 128.82 39.01 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.361 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.05 -34.6 2.51 Favored Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -176.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.627 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 49.2 mtmt -76.63 139.86 40.76 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 177.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -66.95 174.51 25.44 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.85 -0.691 . . . . 0.0 111.45 176.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -58.01 -37.29 74.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.21 -43.48 74.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.383 . . . . 0.0 110.684 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.627 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 3.6 m-20 -72.07 -39.97 68.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.718 -179.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -73.97 71.22 1.55 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.92 176.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.77 ' HG3' ' HD2' ' A' ' 457' ' ' PRO . 20.7 tptm -64.29 135.06 55.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.53 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.551 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 37.2 m -53.72 -51.94 71.95 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -173.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.77 ' HD2' ' HG3' ' A' ' 455' ' ' LYS . 36.2 Cg_exo -61.18 -32.85 91.22 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 121.582 1.521 . . . . 0.0 111.553 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -77.58 -44.7 27.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.727 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 96.9 m -149.71 147.47 28.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 0.0 110.843 -175.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.722 ' HB2' ' HG3' ' A' ' 467' ' ' LYS . 49.4 mmtm -79.19 129.86 34.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.452 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -107.79 125.84 51.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.522 ' HB2' ' NZ ' ' A' ' 467' ' ' LYS . 12.7 tp10 -86.75 -131.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 463' ' ' GLY . . . . . 0.451 ' H ' ' HG3' ' A' ' 462' ' ' GLU . . . -82.3 -41.11 9.48 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.443 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -159.08 45.4 0.45 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.43 ' OG1' ' HE2' ' A' ' 447' ' ' LYS . 9.6 t -163.4 136.73 5.63 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.547 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 447' ' ' LYS . 11.2 t -90.01 145.86 24.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.959 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.722 ' HG3' ' HB2' ' A' ' 460' ' ' LYS . 9.4 ptpp? -144.88 160.48 41.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.666 0.269 . . . . 0.0 110.391 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.736 -0.65 . . . . 0.0 110.821 -176.977 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.674 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.0 m . . . . . 0 CA--C 1.533 0.291 0 CA-C-O 120.73 0.3 . . . . 0.0 111.332 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -53.52 133.01 41.1 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 68.01 33.76 80.01 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.115 -0.948 . . . . 0.0 114.529 171.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.674 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 46.8 mtmt -119.44 147.47 44.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.444 0.622 . . . . 0.0 110.626 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.36 155.48 53.05 Favored Glycine 0 C--O 1.225 -0.409 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.8 -33.99 67.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.297 0.548 . . . . 0.0 111.361 -177.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -57.02 -40.91 77.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.968 0.414 . . . . 0.0 110.535 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.555 ' OD2' ' HD2' ' A' ' 449' ' ' LYS . 33.5 t70 -91.57 -49.18 6.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.061 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.575 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.8 OUTLIER -73.21 92.88 1.79 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 111.832 -177.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -152.7 135.04 15.06 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.58 ' C ' ' H ' ' A' ' 458' ' ' ASP . 2.8 t -167.36 149.99 5.69 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.617 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -73.74 26.07 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.395 2.064 . . . . 0.0 109.798 172.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.58 ' H ' ' C ' ' A' ' 456' ' ' SER . 35.2 t70 -151.5 -43.23 0.11 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.569 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 456' ' ' SER . 73.8 m -71.75 138.87 48.77 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.393 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.409 ' HB3' ' NZ ' ' A' ' 460' ' ' LYS . 6.2 ttpm? -113.3 137.42 51.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.861 0.362 . . . . 0.0 110.719 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.759 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 58.7 t-105 -95.84 122.33 38.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.745 177.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.587 ' HG3' ' HE3' ' A' ' 467' ' ' LYS . 48.0 mm-40 -82.4 -38.43 24.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.186 0.517 . . . . 0.0 110.822 -178.41 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 155.49 -50.31 0.46 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -134.57 29.85 2.95 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 174.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.3 t -175.0 145.18 0.8 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.109 -0.545 . . . . 0.0 109.727 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.759 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 15.8 t -112.76 132.6 55.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.375 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.587 ' HE3' ' HG3' ' A' ' 462' ' ' GLU . 22.4 pttp -178.12 142.67 0.28 Allowed 'General case' 0 C--O 1.233 0.209 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 40.2 t0 . . . . . 0 C--O 1.253 1.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.914 175.94 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.584 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 85.2 m . . . . . 0 CA--C 1.514 -0.439 0 CA-C-O 121.754 0.788 . . . . 0.0 111.324 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -78.73 134.73 37.04 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.808 -177.225 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.7 32.82 35.98 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.509 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -113.51 143.12 45.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.45 163.76 52.91 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.604 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.63 -40.38 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.151 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 452' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 12.5 mptt -74.39 -34.6 63.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -71.61 -45.48 61.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 0.0 110.03 177.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.465 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.1 t -60.45 133.08 55.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.179 176.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 455' ' ' LYS . 30.7 mmtp -128.7 134.4 48.47 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.554 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 8.7 m -54.37 -50.74 83.3 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -173.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.554 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 31.9 Cg_exo -59.02 -28.22 87.25 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.824 1.683 . . . . 0.0 111.267 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -81.22 -54.58 5.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.548 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 95.1 m -155.8 158.88 38.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.101 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -89.37 137.67 32.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.939 0.4 . . . . 0.0 111.459 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.465 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 66.3 t-105 -89.25 117.99 28.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.66 174.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.51 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 6.0 mm-40 -119.05 116.62 26.78 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.958 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 66.15 -66.75 0.14 Allowed Glycine 0 C--N 1.333 0.385 0 O-C-N 123.807 0.692 . . . . 0.0 113.476 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -170.36 38.58 0.19 Allowed Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.403 HG23 ' HE3' ' A' ' 467' ' ' LYS . 14.5 t -159.8 139.98 11.79 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.584 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.7 t -94.82 139.03 31.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -174.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.51 ' HD3' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -155.55 151.87 28.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.34 . . . . 0.0 111.147 -177.568 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.781 -179.493 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.579 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 24.9 p . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.674 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 60.2 tttm -43.75 120.0 1.87 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.826 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.99 -32.83 5.31 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -61.58 152.81 29.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.009 0.433 . . . . 0.0 111.809 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.48 166.52 54.61 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.045 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -55.3 -50.76 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 26.5 tttm -63.85 -43.0 97.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.835 0.35 . . . . 0.0 110.801 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -67.19 -42.91 83.41 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.709 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.427 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 12.1 t -60.45 105.68 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.2 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 455' ' ' LYS . 38.7 mmtm -165.38 43.58 0.08 Allowed 'General case' 0 CA--C 1.498 -1.032 0 CA-C-O 121.854 0.835 . . . . 0.0 108.928 176.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.712 ' HB2' ' CB ' ' A' ' 459' ' ' CYS . 50.3 m -72.19 135.12 82.41 Favored Pre-proline 0 C--N 1.296 -1.737 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.935 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.75 24.44 0.29 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.559 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.685 ' H ' ' C ' ' A' ' 456' ' ' SER . 46.0 t0 -148.69 -27.86 0.3 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 112.818 -1.992 . . . . 0.0 108.84 -176.225 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.712 ' CB ' ' HB2' ' A' ' 456' ' ' SER . 13.7 t -88.49 -174.77 4.72 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.039 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.466 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 5.4 mmmm -158.41 135.02 9.55 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.356 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.427 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 56.3 t-105 -85.79 122.21 29.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -156.68 130.01 8.05 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.894 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.99 36.76 92.45 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.298 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.62 82.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.604 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -157.9 142.45 16.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.357 0.598 . . . . 0.0 110.945 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.674 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 5.5 t -79.32 142.1 36.4 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.1 pttp 178.07 137.87 0.08 Allowed 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.048 0.451 . . . . 0.0 111.217 -177.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 54.1 t0 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.506 -0.759 . . . . 0.0 109.446 174.926 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 79.3 m . . . . . 0 N--CA 1.453 -0.299 0 CA-C-O 120.935 0.397 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -58.9 126.46 27.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.427 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 120.44 -31.44 5.24 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.597 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -70.09 139.48 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.751 0.31 . . . . 0.0 111.329 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.37 165.34 54.32 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.42 -48.36 71.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.179 0.489 . . . . 0.0 111.692 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -67.56 -34.47 77.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.033 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -74.0 -44.32 54.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.853 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.0 t -54.99 119.26 5.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.124 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -90.38 123.64 34.28 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.492 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 28.2 t -57.19 -49.3 94.7 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 39.7 Cg_exo -60.57 -29.94 89.58 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 121.854 1.702 . . . . 0.0 111.786 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -82.32 -49.12 10.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.116 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 20.2 m -140.81 135.95 31.94 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -80.08 122.57 26.94 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.979 0.418 . . . . 0.0 110.484 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.482 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 68.6 t-105 -84.3 126.37 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.46 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 8.9 tt0 -156.97 133.3 9.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.604 0.24 . . . . 0.0 110.734 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.25 34.53 89.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.514 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.18 37.68 95.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.818 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 13.3 t -155.87 141.81 18.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.429 . . . . 0.0 110.314 177.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.482 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 30.9 t -89.05 126.52 35.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.812 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 63.5 pttt -144.25 139.85 28.9 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.805 0.336 . . . . 0.0 110.473 -178.256 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 468' ' ' ASP . . . . . 0.423 ' HB3' ' SG ' ' A' ' 446' ' ' CYS . 3.3 p30 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.636 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 58.1 m . . . . . 0 N--CA 1.442 -0.865 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -78.01 106.81 10.13 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.302 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 59.07 47.39 91.03 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.326 -0.852 . . . . 0.0 114.067 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.8 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 26.9 mtmt -107.55 -169.38 1.52 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.296 0.548 . . . . 0.0 110.25 174.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.44 154.1 36.08 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.29 -35.58 75.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.925 0.363 . . . . 0.0 110.453 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -57.77 -48.37 79.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.412 177.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.625 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.4 OUTLIER -68.92 -54.58 14.66 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.093 176.529 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.8 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 27.6 m -70.98 96.15 1.26 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.014 -0.994 . . . . 0.0 112.826 -174.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -145.9 142.51 28.83 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.561 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.569 ' C ' ' H ' ' A' ' 458' ' ' ASP . 3.3 t 174.71 149.26 0.25 Allowed Pre-proline 0 C--N 1.317 -0.814 0 O-C-N 124.138 0.899 . . . . 0.0 109.113 -178.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.76 27.88 0.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.268 1.979 . . . . 0.0 109.945 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.569 ' H ' ' C ' ' A' ' 456' ' ' SER . 11.6 t70 -150.58 -43.36 0.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.961 -177.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 456' ' ' SER . 62.1 m -68.56 134.32 49.84 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 174.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -125.34 149.76 47.81 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.848 -175.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.514 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 29.7 t-105 -101.49 131.03 47.84 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.667 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.591 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 40.0 tp10 -158.73 122.08 3.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.821 0.343 . . . . 0.0 110.905 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.37 41.55 98.07 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.52 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.1 41.85 99.67 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.12 -0.562 . . . . 0.0 112.764 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -169.97 147.86 3.36 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.06 0.457 . . . . 0.0 110.451 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.514 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.6 OUTLIER -95.27 145.42 25.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.255 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.591 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 62.3 pttt -157.25 149.05 22.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.049 0.452 . . . . 0.0 111.933 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 59.9 t0 . . . . . 0 C--O 1.248 1.009 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.103 174.723 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.495 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 67.5 m . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 121.252 0.549 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -71.32 118.33 13.99 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.535 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.76 23.97 61.12 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.499 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 23.1 ttmm -90.41 138.4 31.57 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -71.19 164.62 53.7 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.741 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.13 -37.91 78.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 117.013 0.406 . . . . 0.0 111.783 -177.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -74.66 -39.61 61.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.825 0.345 . . . . 0.0 110.599 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -70.05 -40.69 74.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.797 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.532 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.0 t -61.53 125.97 25.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.624 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.462 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 7.8 ptpp? -124.79 132.28 53.36 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.333 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.517 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.5 m -52.83 -47.95 93.05 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -59.51 -25.93 80.35 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.718 1.612 . . . . 0.0 111.94 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.462 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 26.0 t70 -92.99 -46.56 7.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.52 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.508 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 85.4 m -147.23 156.34 42.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 110.83 -178.382 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -90.03 120.27 31.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.64 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.532 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 70.6 t-105 -81.69 117.56 22.12 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -84.03 -37.65 21.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.02 0.438 . . . . 0.0 110.499 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 166.74 -46.03 0.26 Allowed Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.342 -0.703 . . . . 0.0 111.342 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -131.67 -10.3 2.36 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 11.2 m -130.26 136.03 48.74 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.967 0.413 . . . . 0.0 110.7 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 18.2 t -92.46 119.86 32.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.437 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.27 133.21 49.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.052 -175.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 35.2 t70 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.576 -0.726 . . . . 0.0 110.869 178.423 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.447 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 76.7 m . . . . . 0 N--CA 1.452 -0.346 0 CA-C-O 120.798 0.333 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -48.38 122.34 5.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.924 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 61.35 33.51 84.82 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.411 -0.813 . . . . 0.0 113.907 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.749 ' HD3' ' HA ' ' A' ' 454' ' ' CYS . 18.2 ptmt -85.31 -19.94 30.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.174 0.487 . . . . 0.0 110.954 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 103.65 150.78 21.88 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.806 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 451' ' ' GLU . . . . . 0.414 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 29.1 tt0 -63.37 -43.1 98.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 122.455 0.302 . . . . 0.0 111.44 -175.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.52 42.04 0.81 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.365 0.603 . . . . 0.0 110.563 177.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -160.62 -38.14 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.445 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 449' ' ' LYS . 19.9 t -74.49 73.98 1.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.09 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.5 132.83 47.65 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.3 m -50.19 -50.31 70.77 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -171.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 456' ' ' SER . 20.2 Cg_endo -61.6 -31.61 87.07 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.839 1.693 . . . . 0.0 111.688 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -83.29 -44.1 15.29 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.4 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.21 146.3 26.75 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -86.26 128.34 34.9 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.706 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.617 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 64.8 t-105 -96.13 111.15 23.27 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 174.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -82.88 47.11 1.16 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.978 0.418 . . . . 0.0 110.971 -176.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 57.95 38.13 87.78 Favored Glycine 0 C--N 1.33 0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.688 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 152.47 -37.48 0.79 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.179 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 24.4 m -123.16 129.16 51.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.201 . . . . 0.0 111.218 -177.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.617 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 23.2 t -82.01 138.06 34.97 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.33 141.43 32.36 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.01 0.433 . . . . 0.0 110.754 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.994 -178.467 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.9 m . . . . . 0 N--CA 1.449 -0.525 0 CA-C-O 120.731 0.3 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 81.1 tttt 33.07 75.67 0.05 OUTLIER 'General case' 0 C--O 1.235 0.294 0 N-CA-C 114.379 1.252 . . . . 0.0 114.379 176.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 448' ' ' GLY . . . . . 0.702 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . 48.66 35.1 15.93 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 114.562 -1.199 . . . . 0.0 115.37 169.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.7 ' HG3' ' HB2' ' A' ' 454' ' ' CYS . 0.3 OUTLIER -85.81 149.45 25.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.921 0.86 . . . . 0.0 108.84 173.111 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -56.04 150.97 22.61 Favored Glycine 0 C--O 1.227 -0.318 0 C-N-CA 121.444 -0.408 . . . . 0.0 113.384 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.6 -33.48 66.27 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.79 -176.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 452' ' ' LYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 452' ' ' LYS . 27.3 mmtp -61.66 -37.93 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.87 0.367 . . . . 0.0 110.204 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -81.06 -48.04 12.74 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.781 175.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.7 ' HB2' ' HG3' ' A' ' 449' ' ' LYS . 0.5 OUTLIER -84.58 116.71 23.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.519 -173.715 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -89.43 139.81 30.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.837 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.538 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 10.5 t -58.78 -48.79 96.17 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.994 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.3 Cg_endo -58.51 -29.85 89.99 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.853 1.702 . . . . 0.0 112.007 178.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -84.05 -42.32 16.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 67.7 m -141.58 149.82 41.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.372 -173.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -79.37 135.69 36.78 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.998 0.428 . . . . 0.0 110.532 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 52.3 t-105 -106.28 132.35 52.44 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.855 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.422 ' OE2' ' HD2' ' A' ' 467' ' ' LYS . 30.2 mt-10 -129.64 79.94 1.93 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.856 0.36 . . . . 0.0 111.402 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.29 -63.11 2.96 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.363 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.1 36.49 0.53 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.833 -0.698 . . . . 0.0 111.786 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.0 t -157.87 141.94 15.91 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.702 ' H ' ' HA2' ' A' ' 448' ' ' GLY . 0.5 OUTLIER -104.7 145.93 29.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.879 -178.22 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.422 ' HD2' ' OE2' ' A' ' 462' ' ' GLU . 18.5 ptpt -163.52 159.46 22.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.987 0.422 . . . . 0.0 111.764 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.2 t0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.967 176.427 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.404 ' HB2' ' HA ' ' A' ' 467' ' ' LYS . 83.5 m . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 120.735 0.303 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -64.74 117.73 7.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 139.25 -35.97 1.91 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -175.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.78 137.75 54.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.131 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.76 -169.99 41.94 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 169.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -67.11 -34.89 78.58 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 117.108 0.454 . . . . 0.0 111.234 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.67 -38.92 53.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.118 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.44 -49.07 67.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.511 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 4.7 t -62.4 123.46 18.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.347 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 51.5 mttm -141.91 33.28 1.58 Allowed 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 122.023 0.916 . . . . 0.0 110.114 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.664 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 39.0 m 45.67 50.12 7.41 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 113.059 -1.882 . . . . 0.0 113.136 178.134 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' A' ' 456' ' ' SER . 5.2 Cg_exo -74.33 -44.75 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.902 1.735 . . . . 0.0 109.88 175.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.01 36.81 0.15 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 173.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 456' ' ' SER . 57.4 m -147.89 145.42 28.65 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.756 -171.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -114.41 136.47 52.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.747 0.308 . . . . 0.0 110.616 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 58.8 t-105 -80.94 118.63 22.59 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.791 ' HB3' ' HD2' ' A' ' 467' ' ' LYS . 34.2 tt0 -155.06 133.09 11.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.657 0.265 . . . . 0.0 110.724 -175.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.39 35.94 81.5 Favored Glycine 0 C--O 1.234 0.122 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.794 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 62.17 40.1 98.52 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.514 HG22 ' HG3' ' A' ' 467' ' ' LYS . 5.3 m -157.76 133.77 9.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.804 0.335 . . . . 0.0 110.529 -175.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 466' ' ' CYS . . . . . . . . . . . . . 11.9 t -86.62 119.41 26.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.791 ' HD2' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -157.85 155.12 29.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.752 -173.291 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.267 -0.873 . . . . 0.0 111.197 -176.493 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 65.1 m . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 120.592 0.234 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -62.64 120.83 11.94 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.277 -177.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 115.31 -17.43 16.67 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.292 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.636 ' HB3' ' HB3' ' A' ' 453' ' ' ASP . 42.6 mtmt -81.74 142.3 32.77 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.857 0.328 . . . . 0.0 110.825 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.61 167.15 50.74 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -56.95 -38.55 73.09 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -69.54 -31.09 69.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.774 0.321 . . . . 0.0 111.263 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.636 ' HB3' ' HB3' ' A' ' 449' ' ' LYS . 2.3 t0 -81.57 -38.67 25.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.0 109.519 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -60.61 145.73 47.89 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.559 174.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.484 ' HD2' ' O ' ' A' ' 453' ' ' ASP . 7.8 mptt -137.29 148.78 46.63 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.287 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.508 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 3.5 m -63.41 -47.51 83.73 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 456' ' ' SER . 37.7 Cg_endo -65.25 -29.38 55.2 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 121.029 1.152 . . . . 0.0 110.965 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.54 -48.36 22.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.41 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 36.4 m -158.06 -162.17 1.11 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.175 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -121.65 136.92 54.93 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.313 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.461 ' CE3' ' HB2' ' A' ' 466' ' ' CYS . 71.9 t-105 -103.18 124.75 49.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.6 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -135.5 110.88 9.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.761 0.315 . . . . 0.0 110.781 -178.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 70.09 -67.02 0.68 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.668 -0.696 . . . . 0.0 113.034 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -169.44 43.08 0.21 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -157.78 138.22 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.938 0.399 . . . . 0.0 110.032 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.461 ' HB2' ' CE3' ' A' ' 461' ' ' TRP . 14.7 t -106.86 130.51 54.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.212 -176.696 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -161.49 150.68 16.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.168 0.508 . . . . 0.0 112.025 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 37.3 t0 . . . . . 0 C--O 1.245 0.859 0 CA-C-O 118.07 -0.967 . . . . 0.0 109.382 179.595 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.629 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 36.4 m . . . . . 0 N--CA 1.449 -0.49 0 CA-C-O 120.694 0.283 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -73.29 132.24 42.87 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.314 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 70.49 34.42 67.95 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.898 -0.592 . . . . 0.0 113.758 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -88.39 -49.6 6.84 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.332 -0.511 . . . . 0.0 110.731 176.144 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 105.21 150.84 20.14 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -171.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.01 -41.78 92.88 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.108 0.454 . . . . 0.0 112.104 -171.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -68.06 -38.89 82.96 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.706 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.75 -43.41 65.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.946 0.403 . . . . 0.0 110.415 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 34.2 t -54.76 120.27 6.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.171 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 12.0 tptt -89.28 123.03 33.11 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.483 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.0 m -58.92 -50.87 85.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -174.092 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 456' ' ' SER . 25.2 Cg_endo -61.37 -30.88 88.12 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 121.61 1.54 . . . . 0.0 111.811 178.762 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.73 -46.18 22.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.371 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 468' ' ' ASP . 66.3 m -148.15 143.23 26.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.102 0.477 . . . . 0.0 110.808 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -79.32 159.16 27.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.69 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.644 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 39.2 t-105 -102.09 124.12 47.14 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.247 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -106.71 59.61 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.359 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.49 -55.04 4.08 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.604 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.8 31.41 0.61 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.308 -0.717 . . . . 0.0 111.308 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 40.2 m -143.17 129.09 19.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.507 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.644 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 46.9 t -91.81 117.08 29.44 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.286 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.08 134.61 1.6 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 468' ' ' ASP . . . . . 0.569 ' HB2' ' HA ' ' A' ' 459' ' ' CYS . 32.0 t70 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.362 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.46 ' SG ' ' HD3' ' A' ' 449' ' ' LYS . 11.8 t . . . . . 0 CA--C 1.52 -0.209 0 CA-C-O 122.09 0.948 . . . . 0.0 109.36 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 89.2 tttt -70.6 126.23 29.04 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.146 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 131.97 -30.56 3.19 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.193 -178.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.46 ' HD3' ' SG ' ' A' ' 446' ' ' CYS . 30.9 mtpp -76.07 137.47 40.2 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.257 0.551 . . . . 0.0 111.123 -177.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -78.48 162.25 49.14 Favored Glycine 0 C--O 1.22 -0.728 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.372 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.86 -35.32 76.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.718 0.759 . . . . 0.0 110.648 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -84.16 40.52 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.305 0.574 . . . . 0.0 110.316 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -164.09 -50.39 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.867 -177.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.86 132.83 40.59 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 21.5 tptm -144.61 45.95 1.38 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.789 0.804 . . . . 0.0 110.779 -171.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.668 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 20.3 m 44.25 44.47 1.55 Allowed Pre-proline 0 C--N 1.314 -0.95 0 CA-C-N 114.084 -1.416 . . . . 0.0 114.266 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.596 ' HD3' ' N ' ' A' ' 456' ' ' SER . 4.5 Cg_endo -82.05 -48.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.921 1.747 . . . . 0.0 110.326 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.425 ' H ' ' HD2' ' A' ' 457' ' ' PRO . 8.5 t70 -148.25 37.9 0.86 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 173.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.668 ' O ' ' HA ' ' A' ' 456' ' ' SER . 4.0 m -148.64 132.66 17.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.85 -172.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.33 136.58 45.81 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.189 177.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.458 ' HE3' ' SG ' ' A' ' 466' ' ' CYS . 32.2 t-105 -85.93 126.45 34.11 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.031 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.59 121.33 9.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.761 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 55.53 45.75 83.34 Favored Glycine 0 N--CA 1.453 -0.191 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.999 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.78 35.94 92.0 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.589 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 60.9 m -155.17 134.22 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.552 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -85.52 130.63 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.018 178.686 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -168.28 133.8 1.82 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 60.4 t0 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.964 -0.541 . . . . 0.0 109.773 -179.726 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.685 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 34.3 m . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 120.714 0.292 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 83.1 tttt -56.51 133.33 53.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.628 -177.245 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 102.18 -28.59 15.25 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.746 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -65.1 144.15 57.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.004 0.43 . . . . 0.0 111.71 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 162.61 54.72 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.457 178.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -59.78 -42.92 94.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.299 0.549 . . . . 0.0 111.051 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -65.83 -36.39 83.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.782 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -75.15 -45.62 39.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.743 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 51.0 t -56.68 119.07 5.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.282 -178.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -81.04 109.44 15.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.526 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.6 m -59.97 -48.66 94.16 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -171.439 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.0 Cg_endo -58.28 -38.74 89.53 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 121.175 1.25 . . . . 0.0 111.356 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -77.16 -47.99 18.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.4 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.62 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 16.5 m -127.06 132.6 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -79.99 130.82 35.57 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.941 0.401 . . . . 0.0 110.913 -176.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -82.3 122.46 27.98 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -166.44 137.65 3.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.718 0.294 . . . . 0.0 110.485 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 69.77 37.03 75.61 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.453 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 58.12 34.6 73.74 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.393 -0.432 . . . . 0.0 112.773 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 6.1 t -167.68 157.6 10.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.014 0.435 . . . . 0.0 110.119 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.685 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 14.4 t -82.36 120.8 25.89 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.469 -176.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 459' ' ' CYS . 74.1 mmtt -90.73 146.51 23.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.751 0.31 . . . . 0.0 111.066 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 40.3 t0 . . . . . 0 C--O 1.246 0.92 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.271 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 73.0 m . . . . . 0 N--CA 1.454 -0.236 0 CA-C-O 120.997 0.427 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.2 tptt -60.33 113.66 2.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.727 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 127.01 -25.56 5.22 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.602 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.516 ' HE3' ' OD2' ' A' ' 453' ' ' ASP . 55.3 mtpt -75.45 141.28 43.17 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 120.933 0.397 . . . . 0.0 111.032 -177.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.31 158.2 50.45 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.961 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 451' ' ' GLU . . . . . 0.538 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 38.9 tt0 -60.25 -36.9 78.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.962 0.381 . . . . 0.0 111.346 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -83.8 37.83 0.61 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.223 0.535 . . . . 0.0 110.844 178.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.516 ' OD2' ' HE3' ' A' ' 449' ' ' LYS . 29.4 t70 -163.52 -50.13 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.909 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 1.7 t -68.12 125.67 27.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.461 176.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 41.6 mmtm -92.26 135.64 33.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -178.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.502 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 23.1 t -60.56 -50.0 87.47 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.502 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 26.7 Cg_exo -62.42 -29.12 78.79 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.632 1.554 . . . . 0.0 111.504 178.194 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.458 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 38.0 t70 -80.8 -42.32 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.241 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.84 134.47 24.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -66.23 115.87 6.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.941 0.401 . . . . 0.0 111.23 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.538 ' CZ2' ' HB2' ' A' ' 451' ' ' GLU . 48.9 t-105 -85.44 119.38 25.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 172.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -154.58 126.03 7.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.695 0.283 . . . . 0.0 110.734 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.58 33.08 75.74 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.082 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.43 39.21 97.48 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 121.188 -0.53 . . . . 0.0 112.37 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.8 t -165.9 145.16 6.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.1 OUTLIER -86.21 135.51 33.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 -175.571 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -130.88 139.72 50.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.009 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 33.4 t70 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.785 -0.626 . . . . 0.0 109.991 178.778 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.558 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 46.0 m . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 120.718 0.294 . . . . 0.0 110.753 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -62.46 133.5 55.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.372 -175.414 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.93 53.87 6.08 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.288 176.954 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.822 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 49.9 mtpt -122.17 -50.71 2.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.994 0.426 . . . . 0.0 111.44 178.238 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 126.53 156.01 9.08 Favored Glycine 0 N--CA 1.444 -0.803 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -172.003 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -61.84 -41.97 98.46 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.323 0.562 . . . . 0.0 111.392 -173.369 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.6 pttm -71.95 -34.78 69.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.624 179.11 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.822 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -75.51 -40.19 57.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.388 -179.033 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.8 t -59.9 118.62 6.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.176 179.025 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -74.72 123.25 24.58 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.235 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.457 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 46.0 m -71.13 -51.57 10.28 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -173.349 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 456' ' ' SER . 28.6 Cg_endo -63.61 -27.33 69.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.512 1.475 . . . . 0.0 111.871 -179.708 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -97.39 -33.17 11.51 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.479 -174.278 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.2 m -129.98 150.27 51.34 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 122.127 -0.358 . . . . 0.0 110.974 -172.848 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.479 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 63.5 mttm -86.87 139.11 30.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.33 -179.119 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.476 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.2 t-105 -111.78 122.74 48.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.523 ' HB3' ' HE3' ' A' ' 467' ' ' LYS . 69.4 tt0 -158.58 134.54 9.04 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.513 0.196 . . . . 0.0 110.866 -175.885 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.35 31.63 81.05 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.354 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.53 37.83 94.94 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.171 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.8 t -165.35 146.91 7.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.097 0.475 . . . . 0.0 110.711 179.398 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.7 t -87.11 147.49 25.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.094 -175.22 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.523 ' HE3' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.71 142.72 27.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.973 0.416 . . . . 0.0 110.456 178.565 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 C--O 1.254 1.317 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.356 -179.128 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.499 ' HA ' ' HB2' ' A' ' 466' ' ' CYS . 26.5 ttpp -58.62 125.2 22.44 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.349 -175.048 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.1 -20.52 4.49 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.255 -176.57 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.874 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 29.7 mtpt -93.45 -152.74 0.34 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.224 -178.113 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -127.83 160.94 21.82 Favored Glycine 0 C--O 1.219 -0.794 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.654 177.93 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -42.6 -43.08 3.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -174.858 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -64.0 -42.9 97.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.232 -178.66 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.755 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 46.6 m-20 -73.11 -51.08 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.658 0.742 . . . . 0.0 109.6 175.247 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.874 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 77.5 m -72.6 53.83 0.32 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 124.907 1.283 . . . . 0.0 111.472 177.391 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.656 ' HE2' ' HG2' ' A' ' 457' ' ' PRO . 20.6 ptmt -63.12 141.95 58.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.556 -177.357 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.519 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 7.3 t -50.4 -48.54 80.85 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.568 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.656 ' HG2' ' HE2' ' A' ' 455' ' ' LYS . 13.5 Cg_endo -57.63 -37.38 97.09 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 121.769 1.646 . . . . 0.0 112.621 -179.367 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -85.42 -36.82 20.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.136 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 456' ' ' SER . 82.0 m -138.54 135.54 35.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.006 -173.026 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.71 ' HB3' ' HB2' ' A' ' 467' ' ' LYS . 83.1 tttt -72.19 143.79 48.76 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 175.076 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.677 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 44.2 t-105 -116.49 126.68 53.7 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.08 -176.535 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.693 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 41.9 tt0 -95.99 -65.64 0.96 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 0.0 110.896 -179.11 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -179.24 87.34 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 68.56 31.65 73.94 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.744 -175.861 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.4 t -166.2 130.17 2.13 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -179.599 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.677 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 1.7 m -77.99 140.73 39.21 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.098 -177.233 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.71 ' HB2' ' HB3' ' A' ' 460' ' ' LYS . 27.1 mmmt -93.72 171.32 8.96 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.465 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 31.4 t70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.802 -169.6 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.841 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 21.4 m . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.641 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 64.2 tttp -54.57 110.57 0.65 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.754 -176.189 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 112.55 -19.35 21.85 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.747 -0.74 . . . . 0.0 113.096 -178.533 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.834 ' HE3' ' HB3' ' A' ' 453' ' ' ASP . 31.1 mmmt -68.86 142.8 54.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 117.01 0.405 . . . . 0.0 111.335 -178.152 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -68.2 163.32 48.5 Favored Glycine 0 C--O 1.224 -0.502 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 175.966 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -55.01 -45.09 75.06 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -175.458 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -65.37 -44.84 86.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.898 0.38 . . . . 0.0 110.595 -179.008 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.834 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -67.13 -44.75 79.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.157 179.226 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 33.4 t -64.88 122.12 16.22 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.49 -175.441 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 68.4 mttm -76.27 122.53 24.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.701 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.503 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 19.4 m -68.39 -50.31 28.4 Favored Pre-proline 0 C--N 1.322 -0.589 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -174.55 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 21.3 Cg_exo -65.01 -37.58 32.61 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 121.247 1.298 . . . . 0.0 110.974 179.076 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 7.7 t70 -71.28 -39.54 71.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.368 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 54.6 m -138.65 140.34 38.83 Favored 'General case' 0 N--CA 1.458 -0.053 0 CA-C-O 121.24 0.543 . . . . 0.0 112.091 -174.051 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 467' ' ' LYS . 62.0 tttp -71.17 135.62 47.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.739 -178.17 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.625 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.4 t-105 -100.77 107.89 19.57 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 174.354 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.493 ' HB2' ' CD ' ' A' ' 467' ' ' LYS . 22.8 tt0 -82.7 50.8 1.75 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.019 0.437 . . . . 0.0 110.875 -177.812 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 54.61 31.68 53.0 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.699 -0.682 . . . . 0.0 113.755 177.931 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 161.45 -40.57 0.4 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.8 179.064 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.7 t -115.37 134.56 54.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.247 0.546 . . . . 0.0 110.812 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.841 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 47.4 t -81.95 140.24 34.13 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.633 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.493 ' CD ' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.34 147.21 30.1 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.417 0.627 . . . . 0.0 111.192 -174.352 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 . . . . . 0 C--N 1.316 -0.88 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.94 -179.473 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.621 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 75.0 m . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 40.8 ttmt -57.67 117.92 4.72 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.011 -176.815 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 56.35 46.32 87.11 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.308 -0.86 . . . . 0.0 113.822 173.842 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.594 ' HD2' ' HA ' ' A' ' 454' ' ' CYS . 12.4 ptpt -90.89 -41.37 11.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 117.203 0.501 . . . . 0.0 111.849 -179.65 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 123.91 151.68 8.24 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.999 -178.857 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 451' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 453' ' ' ASP . 6.4 tm-20 -66.28 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.563 0.181 . . . . 0.0 111.033 -176.049 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -79.15 38.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.175 0.512 . . . . 0.0 110.52 177.676 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 451' ' ' GLU . 50.6 t0 -166.22 -43.85 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.496 -178.93 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.594 ' HA ' ' HD2' ' A' ' 449' ' ' LYS . 53.7 t -64.16 112.15 2.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.242 -176.072 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.435 ' O ' ' HD3' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -170.65 138.24 1.42 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.432 168.911 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 458' ' ' ASP . 12.2 t 170.04 142.15 0.08 OUTLIER Pre-proline 0 C--N 1.315 -0.928 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.2 -176.254 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.77 8.27 1.04 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 121.603 1.535 . . . . 0.0 110.008 172.753 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.495 ' H ' ' C ' ' A' ' 456' ' ' SER . 87.8 m-20 -115.17 -52.17 2.69 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.992 177.972 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 63.8 m -82.44 131.59 35.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.691 179.74 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.48 141.71 44.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.256 -178.85 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -85.87 123.51 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.699 176.218 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -103.87 55.83 0.73 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.855 0.36 . . . . 0.0 110.711 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.62 -52.16 3.11 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.199 -0.524 . . . . 0.0 113.359 179.166 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -152.2 33.88 0.85 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.09 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.5 t -171.4 134.08 0.86 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.881 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.621 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.8 t -91.98 140.66 29.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.286 -0.416 . . . . 0.0 109.911 -176.848 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -168.21 136.56 2.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.159 0.504 . . . . 0.0 111.414 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 56.8 t0 . . . . . 0 C--O 1.248 1.014 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.323 175.674 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 6.4 t . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -63.37 132.12 50.48 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.436 -175.111 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 138.56 -39.26 1.59 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.87 143.64 56.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.388 -0.406 . . . . 0.0 110.751 179.027 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.73 166.0 49.74 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 175.2 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 451' ' ' GLU . . . . . 0.6 ' HG2' ' H ' ' A' ' 452' ' ' LYS . 12.3 pm0 -55.07 -56.76 16.22 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 452' ' ' LYS . . . . . 0.6 ' H ' ' HG2' ' A' ' 451' ' ' GLU . 1.3 mptm? -71.23 -37.11 72.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.853 0.358 . . . . 0.0 110.638 177.949 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -63.6 -34.06 76.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.86 -178.152 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.0 115.64 3.0 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.248 176.166 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -84.48 128.23 34.47 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -177.87 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.611 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 1.9 m -60.27 -54.53 54.24 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -171.909 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 46.6 Cg_exo -57.77 -33.31 96.68 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.733 1.622 . . . . 0.0 111.538 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -77.08 -49.16 15.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.439 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 25.2 m -151.69 136.36 17.07 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.411 -174.949 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -86.16 141.05 29.64 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.102 -0.374 . . . . 0.0 110.175 176.531 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -87.43 118.23 26.75 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.265 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.517 ' HB2' ' HE3' ' A' ' 467' ' ' LYS . 81.3 mt-10 -149.63 132.29 15.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.721 0.296 . . . . 0.0 110.998 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 59.17 38.01 92.53 Favored Glycine 0 N--CA 1.452 -0.245 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.517 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.81 38.54 96.12 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.145 -178.561 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 88.4 m -150.94 128.43 11.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.883 0.373 . . . . 0.0 110.945 -176.703 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 5.9 t -78.06 126.7 31.2 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.951 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.517 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 22.0 pttp -166.4 149.37 7.03 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.712 -175.549 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.9 t70 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.258 -0.877 . . . . 0.0 109.434 174.753 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.525 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 12.6 t . . . . . 0 N--CA 1.454 -0.251 0 CA-C-O 120.575 0.226 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 17.9 tttp -54.59 124.69 17.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.057 0.455 . . . . 0.0 111.089 -176.029 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 83.07 26.99 42.31 Favored Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.51 -0.768 . . . . 0.0 114.647 173.277 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.894 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 42.6 mtpt -84.05 -25.78 29.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.049 0.925 . . . . 0.0 109.226 170.989 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 96.19 141.14 11.65 Favored Glycine 0 C--O 1.215 -1.071 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.619 -177.825 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -45.34 -43.74 11.1 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -171.717 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -57.89 -43.69 86.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.062 0.458 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.72 ' OD2' ' HE2' ' A' ' 449' ' ' LYS . 23.6 t0 -81.5 -45.3 16.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.332 179.524 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.894 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 70.9 m -71.64 64.58 0.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.892 1.277 . . . . 0.0 111.331 174.986 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -65.72 145.4 56.06 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.817 -178.102 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.0 m -56.2 -48.37 97.01 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -175.77 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.3 Cg_endo -62.31 -33.05 81.6 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 121.491 1.461 . . . . 0.0 111.712 177.94 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -79.96 -40.97 26.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.145 -178.469 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 97.9 m -146.14 142.24 28.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.512 -176.308 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -75.2 125.21 28.49 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.851 0.358 . . . . 0.0 110.791 179.367 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.705 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 26.9 t-105 -96.44 115.93 28.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.696 178.966 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -89.07 -47.37 8.15 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.922 0.391 . . . . 0.0 110.907 -178.381 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.76 65.85 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 82.69 37.94 12.85 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.513 -174.137 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -167.56 136.7 2.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.739 0.304 . . . . 0.0 110.393 178.569 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.705 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.0 OUTLIER -102.15 138.9 38.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.194 -176.405 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -172.93 -173.29 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.919 0.39 . . . . 0.0 110.614 176.796 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 31.7 t70 . . . . . 0 C--O 1.248 1.002 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.33 176.404 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.471 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 57.6 m . . . . . 0 N--CA 1.451 -0.376 0 CA-C-O 120.747 0.308 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -64.74 128.38 35.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.113 0.482 . . . . 0.0 110.999 -175.592 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.78 22.2 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.496 -0.774 . . . . 0.0 113.25 177.436 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 446' ' ' CYS . 43.4 mtpt -99.04 -48.82 4.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.128 0.489 . . . . 0.0 110.406 174.127 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 102.75 153.61 24.6 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -175.93 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.04 -39.92 83.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.88 0.34 . . . . 0.0 111.434 -177.499 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -86.57 37.6 0.75 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.249 0.547 . . . . 0.0 111.08 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -157.06 -45.93 0.07 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.333 -0.848 . . . . 0.0 108.889 177.513 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.1 t -63.22 115.91 4.96 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.199 175.003 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.477 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 94.8 mttt -101.74 141.06 35.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.573 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.487 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 22.1 m -56.13 -50.47 87.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.282 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 456' ' ' SER . 32.8 Cg_endo -63.33 -31.64 73.11 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.535 1.49 . . . . 0.0 110.942 177.339 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.477 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 14.6 t70 -71.32 -52.38 19.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.715 179.56 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.493 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 70.8 m -156.65 147.52 21.86 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -178.8 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -81.1 122.87 27.88 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.817 -176.345 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -87.56 106.64 18.14 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 174.383 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -146.62 130.31 16.99 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -174.664 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.18 32.42 84.12 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.788 -175.016 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.48 24.01 69.02 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.282 -177.479 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 57.0 m -132.18 133.75 44.57 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 120.797 0.332 . . . . 0.0 110.459 -177.65 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 31.2 t -88.96 118.77 28.93 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.343 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -161.72 144.61 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -174.587 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 468' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' A' ' 459' ' ' CYS . 9.8 t70 . . . . . 0 C--O 1.245 0.844 0 O-C-N 124.311 1.007 . . . . 0.0 110.972 -179.26 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.559 ' O ' ' HE2' ' A' ' 449' ' ' LYS . 57.9 m . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.706 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 63.5 tttp 59.08 144.97 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.887 0.875 . . . . 0.0 112.844 176.706 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 448' ' ' GLY . . . . . 0.553 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . -73.14 51.86 1.7 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.857 179.311 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.559 ' HE2' ' O ' ' A' ' 446' ' ' CYS . 33.6 mtmt -74.48 -152.21 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 179.773 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -83.26 156.23 33.59 Favored Glycine 0 N--CA 1.443 -0.88 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 174.234 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -41.07 98.53 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.685 0.279 . . . . 0.0 111.301 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -69.05 -34.05 74.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.835 0.35 . . . . 0.0 110.51 179.942 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.33 -51.83 27.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.663 176.986 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 16.0 t -53.67 129.84 34.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.032 174.953 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.97 116.81 23.58 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 173.88 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.571 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 25.0 m -65.93 -47.04 64.92 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.413 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.1 Cg_endo -57.98 -38.44 92.05 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.667 1.578 . . . . 0.0 111.645 177.591 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -76.76 -48.22 19.34 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.175 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 60.6 m -130.4 142.54 50.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 111.189 -175.178 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -76.95 133.98 39.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.072 0.463 . . . . 0.0 110.99 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -102.98 119.84 39.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.479 176.512 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -159.94 143.68 14.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.686 0.279 . . . . 0.0 110.674 178.684 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.17 32.1 79.33 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.285 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.13 41.82 99.63 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.975 179.375 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.7 t -160.4 146.89 15.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.012 0.434 . . . . 0.0 110.496 178.963 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.706 ' HB3' ' O ' ' A' ' 447' ' ' LYS . 20.6 t -97.48 121.25 39.16 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.711 -176.748 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -133.56 141.85 47.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.792 0.33 . . . . 0.0 111.576 -175.869 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.519 -0.753 . . . . 0.0 109.718 175.036 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.48 ' SG ' ' HD2' ' A' ' 449' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -55.1 113.0 1.19 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.909 0.385 . . . . 0.0 110.982 -174.713 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.83 -30.86 3.03 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.295 -174.51 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.48 ' HD2' ' SG ' ' A' ' 446' ' ' CYS . 96.0 mttt -63.93 140.41 58.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.733 -0.233 . . . . 0.0 110.996 178.429 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.52 172.67 47.89 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 171.818 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.82 -41.73 78.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.277 0.539 . . . . 0.0 111.101 -178.594 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -71.57 -41.75 68.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.487 -178.444 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.62 -35.57 80.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.293 0.568 . . . . 0.0 110.451 177.008 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 15.9 t -68.37 109.16 3.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.522 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -85.18 126.92 34.04 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.528 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -59.4 -49.58 91.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -175.725 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.4 Cg_endo -61.0 -33.21 92.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.716 1.611 . . . . 0.0 111.67 178.659 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -78.04 -45.39 23.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.505 -179.681 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 57.6 m -146.87 143.14 28.34 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 -178.901 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 467' ' ' LYS . 16.4 ptpt -86.41 135.54 33.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.205 0.526 . . . . 0.0 110.798 178.237 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.403 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 77.2 t-105 -95.28 121.14 36.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.52 -175.859 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -81.52 -135.72 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.485 178.56 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.81 -43.1 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.317 177.1 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.28 44.68 0.55 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.549 -0.621 . . . . 0.0 111.549 179.542 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.6 t -162.29 136.19 6.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.368 0.604 . . . . 0.0 110.554 178.684 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 35.5 t -96.29 134.9 38.84 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.47 -0.786 . . . . 0.0 108.943 178.415 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.497 ' HD3' ' O ' ' A' ' 460' ' ' LYS . 0.0 OUTLIER -153.0 135.07 14.8 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.911 -0.716 . . . . 0.0 111.715 -178.113 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 23.2 t70 . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.486 -179.807 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 2.4 t . . . . . 0 N--CA 1.463 0.182 0 CA-C-O 121.354 0.597 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 62.0 tttp -75.76 128.17 34.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.176 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 133.22 -37.93 1.93 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.281 179.3 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.271 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.33 179.42 25.08 Favored Glycine 0 C--O 1.226 -0.359 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.7 175.889 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.98 -43.75 94.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.219 0.51 . . . . 0.0 111.558 -176.546 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.93 -40.47 91.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.044 0.45 . . . . 0.0 110.354 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -69.95 -41.01 75.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.912 -179.62 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.5 114.12 2.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.098 -177.355 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 49.8 mtmt -72.6 117.23 14.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 176.048 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.507 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.7 t -64.59 -50.35 65.68 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -173.883 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 456' ' ' SER . 29.6 Cg_endo -61.47 -29.81 85.68 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.632 1.555 . . . . 0.0 111.649 178.514 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.562 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 1.0 OUTLIER -85.35 -40.91 15.97 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.221 -176.032 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.5 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 9.2 m -137.88 144.66 41.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.678 0.275 . . . . 0.0 110.452 -174.629 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 460' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 460' ' ' LYS . 4.4 mptp? -80.9 148.02 30.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.089 0.471 . . . . 0.0 110.532 178.67 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -107.43 123.02 47.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.454 178.874 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.515 ' HG2' ' H ' ' A' ' 463' ' ' GLY . 22.9 tt0 -85.33 -136.67 0.06 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 177.268 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 463' ' ' GLY . . . . . 0.515 ' H ' ' HG2' ' A' ' 462' ' ' GLU . . . -73.88 -42.76 36.93 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 110.904 -0.879 . . . . 0.0 110.904 175.132 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.99 42.59 0.48 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 177.456 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 91.2 m -148.47 129.19 14.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.811 0.339 . . . . 0.0 110.943 -176.96 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.547 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 8.7 t -83.6 135.79 34.48 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.139 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -159.78 134.89 8.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.467 0.651 . . . . 0.0 111.887 -179.659 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.684 178.12 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.578 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 63.8 m . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 120.695 0.283 . . . . 0.0 110.592 . . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -71.85 125.67 27.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 110.595 -177.004 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 130.08 -29.57 3.68 Favored Glycine 0 N--CA 1.441 -0.971 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.315 -178.803 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.544 ' HB2' ' CB ' ' A' ' 453' ' ' ASP . 9.8 pttm -97.45 139.11 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.638 178.942 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.22 -168.88 14.54 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.418 -174.76 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.32 -40.87 90.2 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 122.658 0.383 . . . . 0.0 111.484 -176.785 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -62.5 -41.52 98.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.154 0.502 . . . . 0.0 110.119 178.071 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.544 ' CB ' ' HB2' ' A' ' 449' ' ' LYS . 90.6 m-20 -73.73 -41.61 62.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.528 -179.411 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 7.8 t -63.41 118.76 8.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.84 -176.038 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -156.65 172.97 17.64 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.545 -178.779 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.434 ' OG ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 t 68.58 147.61 0.11 Allowed Pre-proline 0 C--O 1.226 -0.159 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.178 175.11 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.434 ' HD2' ' OG ' ' A' ' 456' ' ' SER . 27.3 Cg_endo -61.64 -1.56 2.11 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.507 2.138 . . . . 0.0 111.748 177.684 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.35 -37.28 68.88 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.1 174.949 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.49 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 79.8 m -135.64 131.86 36.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.367 177.081 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -105.96 133.39 50.75 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.979 -177.818 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -85.82 132.68 34.06 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 174.689 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -157.31 128.98 6.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.056 -0.257 . . . . 0.0 111.01 -178.132 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.54 -70.59 0.37 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.015 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -175.57 31.69 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 177.471 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.1 m -151.23 134.85 16.32 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -177.014 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 17.0 t -84.97 125.82 33.01 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.049 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.491 ' HA ' ' HB2' ' A' ' 446' ' ' CYS . 22.5 pttp -156.79 144.01 18.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.671 0.272 . . . . 0.0 111.065 -176.247 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.887 -176.987 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.789 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 73.2 m . . . . . 0 N--CA 1.439 -0.997 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -67.42 105.67 1.87 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.104 179.872 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 137.52 -28.19 2.79 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.213 -179.643 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -86.6 154.34 21.12 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.416 -176.902 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.57 177.44 30.06 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.83 -176.253 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.01 -50.74 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.844 -0.209 . . . . 0.0 110.973 -177.9 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -68.18 -31.07 70.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.936 0.398 . . . . 0.0 110.535 179.55 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.55 -34.73 72.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.02 178.571 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 48.9 t -60.12 116.76 4.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.23 179.842 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.492 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 35.9 mtmm -81.04 124.78 29.46 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.709 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.425 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 9.6 m -62.93 -54.08 49.92 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -172.418 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.5 Cg_endo -62.08 -28.37 80.05 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.475 1.45 . . . . 0.0 111.235 178.976 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.492 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 45.3 t0 -75.03 -50.96 14.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.972 178.089 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.498 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 98.2 m -148.54 148.39 30.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.404 0.621 . . . . 0.0 111.509 -175.169 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -92.35 139.58 30.45 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.282 177.241 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 48.9 t-105 -77.2 119.78 21.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.158 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -149.3 130.42 14.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.84 0.352 . . . . 0.0 110.454 -176.587 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.75 38.27 91.66 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.377 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.95 84.01 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.258 -0.496 . . . . 0.0 112.313 -177.815 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 85.9 m -150.82 135.84 17.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.695 0.283 . . . . 0.0 110.287 -177.002 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.789 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 20.0 t -78.63 124.94 28.7 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -161.39 134.28 6.21 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.137 0.494 . . . . 0.0 111.39 -174.907 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 468' ' ' ASP . . . . . 0.433 ' HB3' ' HA ' ' A' ' 459' ' ' CYS . 29.4 p-10 . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.642 177.91 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.881 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 81.9 m . . . . . 0 N--CA 1.453 -0.286 0 CA-C-O 120.797 0.332 . . . . 0.0 110.425 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 1.1 tmtp? -52.76 127.41 23.18 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.543 -178.795 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 108.89 -28.57 11.03 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.606 -178.868 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.881 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 57.0 mtmt -72.28 144.68 48.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.793 0.296 . . . . 0.0 111.132 -178.888 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.84 175.25 34.92 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 175.935 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.52 -37.09 74.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 117.346 0.573 . . . . 0.0 111.459 -177.253 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -68.6 -41.67 79.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.234 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 453' ' ' ASP . . . . . 0.613 ' HB3' ' HD2' ' A' ' 449' ' ' LYS . 1.1 m-20 -75.96 -36.87 59.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 110.56 178.852 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.48 ' SG ' ' N ' ' A' ' 455' ' ' LYS . 36.9 t -77.55 -157.73 0.1 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.351 179.589 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 455' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 454' ' ' CYS . 27.7 mmmt 61.36 49.67 5.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.862 0.839 . . . . 0.0 110.749 -175.282 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.46 ' C ' ' H ' ' A' ' 458' ' ' ASP . 0.9 OUTLIER -71.77 171.72 8.59 Favored Pre-proline 0 C--N 1.31 -1.127 0 CA-C-N 114.438 -1.255 . . . . 0.0 108.974 176.06 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 456' ' ' SER . 71.8 Cg_endo -77.57 29.07 0.43 Allowed 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.102 1.868 . . . . 0.0 111.097 175.949 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 458' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' A' ' 456' ' ' SER . 49.6 t0 -158.52 -49.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.489 -179.121 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 69.3 m -79.34 137.54 37.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.991 -179.484 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -115.22 160.48 19.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.306 0.574 . . . . 0.0 111.594 -178.563 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.449 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 37.1 t-105 -91.46 136.27 33.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.79 179.202 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.54 ' O ' HG22 ' A' ' 465' ' ' THR . 36.8 tt0 -128.24 75.38 1.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.944 0.402 . . . . 0.0 111.691 -177.59 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 60.78 57.96 16.19 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.756 175.383 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 78.99 40.79 15.69 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.947 178.762 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.54 HG22 ' O ' ' A' ' 462' ' ' GLU . 6.3 t -166.87 143.12 4.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 175.334 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.621 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 36.6 t -98.91 139.73 34.13 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.576 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 21.9 pttp -153.54 152.13 30.58 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.993 0.425 . . . . 0.0 111.103 -178.363 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.337 175.251 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.753 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 59.0 m . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -56.01 107.71 0.38 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.31 -173.65 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 78.32 56.07 3.8 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.673 -0.694 . . . . 0.0 113.875 177.297 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.622 ' HG2' ' O ' ' A' ' 446' ' ' CYS . 14.5 ptpt -129.57 166.79 19.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.219 0.51 . . . . 0.0 110.692 173.451 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 165.11 54.68 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.086 -177.781 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.45 -35.11 78.57 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.318 0.247 . . . . 0.0 111.104 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 39.25 0.71 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.643 0.735 . . . . 0.0 110.388 176.694 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -156.28 -44.51 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.576 -178.566 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.48 129.46 39.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.039 176.507 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -106.73 117.76 34.91 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.325 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.51 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 26.1 t -56.95 -48.43 97.43 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -173.601 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.2 Cg_endo -58.01 -30.13 89.05 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.625 1.55 . . . . 0.0 112.187 -179.227 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -87.95 -45.08 10.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.156 -179.842 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.497 ' O ' ' HA ' ' A' ' 456' ' ' SER . 68.4 m -143.13 142.08 31.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.947 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -89.05 147.23 24.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.731 0.777 . . . . 0.0 112.008 -175.265 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -94.82 119.52 33.54 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.345 179.615 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -146.07 129.89 17.2 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.572 0.225 . . . . 0.0 110.756 -179.161 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.67 42.68 96.37 Favored Glycine 0 N--CA 1.454 -0.152 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.221 -178.929 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 57.18 34.71 67.52 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.061 -177.025 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 32.7 m -143.93 130.72 20.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.715 0.293 . . . . 0.0 110.874 -175.038 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.1 t -88.64 134.61 33.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.98 178.654 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -172.53 154.34 3.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 111.229 -179.448 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 7.6 t70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.306 -0.854 . . . . 0.0 109.478 175.057 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.796 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 70.8 m . . . . . 0 N--CA 1.451 -0.392 0 CA-C-O 120.624 0.25 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -61.58 130.87 48.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -173.323 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.5 17.01 79.81 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.52 -0.763 . . . . 0.0 114.4 175.187 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 449' ' ' LYS . . . . . 0.796 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 50.8 mtmt -93.19 137.94 32.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 117.972 0.886 . . . . 0.0 110.327 173.868 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.47 166.18 51.29 Favored Glycine 0 C--O 1.223 -0.538 0 C-N-CA 121.018 -0.611 . . . . 0.0 111.854 178.622 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 451' ' ' GLU . . . . . 0.424 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 37.1 tt0 -59.26 -34.71 72.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.033 0.444 . . . . 0.0 111.635 -177.218 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -69.67 -44.38 70.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.803 0.335 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.54 -44.35 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.603 -179.015 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 454' ' ' CYS . . . . . 0.553 ' SG ' ' HE3' ' A' ' 449' ' ' LYS . 0.3 OUTLIER -80.29 115.9 20.08 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.305 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -87.95 148.05 24.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 178.773 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 456' ' ' SER . . . . . 0.493 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -62.96 -51.75 68.69 Favored Pre-proline 0 C--N 1.322 -0.606 0 O-C-N 123.347 0.404 . . . . 0.0 111.605 -179.845 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 457' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.1 Cg_endo -61.81 -30.98 85.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.599 1.533 . . . . 0.0 111.46 176.584 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -71.71 -47.99 50.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.008 178.357 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 459' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 63.4 m -148.55 143.12 26.42 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.157 -173.584 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.02 124.28 23.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.956 0.408 . . . . 0.0 110.781 -178.303 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 461' ' ' TRP . . . . . 0.583 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 60.3 t-105 -107.08 126.56 52.51 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.685 178.339 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 462' ' ' GLU . . . . . 0.884 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 21.3 tt0 -90.61 -60.5 1.9 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.975 0.417 . . . . 0.0 110.133 -179.176 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 176.55 40.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 178.286 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 147.55 -41.78 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -176.215 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.6 m -104.84 134.17 48.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.469 -0.365 . . . . 0.0 111.311 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 466' ' ' CYS . . . . . 0.583 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 1.8 t -101.09 145.1 29.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.971 178.666 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 467' ' ' LYS . . . . . 0.884 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 0.5 OUTLIER -148.16 140.17 24.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.123 0.487 . . . . 0.0 111.53 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 5.9 t70 . . . . . 0 C--O 1.251 1.158 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.507 179.676 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 18.4 m -67.64 123.58 20.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.651 0.262 . . . . 0.0 110.626 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -167.11 -31.93 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.173 -175.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -149.52 -35.31 0.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.999 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 24.8 m 59.19 37.36 23.91 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.03 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 24.7 pttm -175.4 -34.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.782 176.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 24.2 m 68.59 135.97 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.75 0.656 . . . . 0.0 111.874 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -62.03 -48.6 82.24 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.816 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 16.7 m -88.57 147.09 38.78 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-O 120.611 0.243 . . . . 0.0 110.755 175.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -62.52 -31.56 80.2 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.818 2.346 . . . . 0.0 112.201 -178.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 12.1 t 60.32 52.36 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-O 121.377 0.608 . . . . 0.0 110.368 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 28.1 m -65.05 126.68 28.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.849 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -79.61 -53.42 6.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.556 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 4.9 t -171.58 141.31 1.47 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.637 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -142.98 47.76 1.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.554 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 11.9 t 42.99 48.07 5.07 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.864 0.84 . . . . 0.0 111.955 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.78 -29.14 68.26 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.867 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -68.35 -44.03 76.17 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.186 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -66.85 153.42 43.48 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.692 0.282 . . . . 0.0 110.874 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.1 36.86 0.24 Allowed 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.063 178.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 88.6 m 69.37 -57.91 0.52 Allowed 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.437 0.695 . . . . 0.0 111.361 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.6 m -154.54 103.54 2.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 443' ' ' ALA . . . . . 0.466 ' C ' ' H ' ' A' ' 445' ' ' LYS . . . -75.51 84.98 2.59 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.592 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -76.1 28.07 0.12 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.154 0.502 . . . . 0.0 111.897 -178.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.466 ' H ' ' C ' ' A' ' 443' ' ' ALA . 34.9 mmtp -89.37 -25.49 21.55 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.416 169.243 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.419 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 57.0 m -73.34 -45.12 57.05 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.786 175.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 14.3 tptm -60.73 118.15 6.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.598 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.52 -25.87 8.88 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.146 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.596 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 68.4 mttm -69.33 144.02 53.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.61 0.243 . . . . 0.0 111.565 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -77.79 176.12 53.98 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 171.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -56.31 -44.34 79.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.858 0.329 . . . . 0.0 111.24 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -64.91 -40.63 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 47.2 m-20 -69.33 -43.62 73.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.711 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 8.7 t -60.93 111.32 1.62 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.733 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.661 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 95.0 mttt -82.95 127.03 33.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.554 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 69.8 m -61.39 -49.0 89.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -58.37 -28.3 84.45 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 121.796 1.664 . . . . 0.0 111.96 177.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.661 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 0.7 OUTLIER -86.87 -45.67 10.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.991 -178.219 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.1 m -140.77 146.63 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.73 -172.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.499 ' HG3' ' HG3' ' A' ' 462' ' ' GLU . 24.7 tptp -88.7 112.9 23.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.478 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -83.87 106.92 15.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.504 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 51.4 mt-10 -138.42 132.33 31.22 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.154 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.19 41.39 99.47 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.685 -0.688 . . . . 0.0 112.836 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.06 36.29 92.09 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.319 -0.467 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 89.1 m -149.97 129.23 12.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.787 0.327 . . . . 0.0 110.511 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 22.8 t -87.53 126.51 34.96 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.504 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 52.1 pttt -151.4 142.57 23.22 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.569 0.699 . . . . 0.0 112.146 -174.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 C--O 1.247 0.972 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.446 175.791 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.725 0 N-CA-C 112.158 -0.377 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 7.9 m -90.34 -38.37 13.4 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.831 0.348 . . . . 0.0 110.881 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 423' ' ' LYS . . . . . 0.764 ' HA ' ' HE2' ' A' ' 423' ' ' LYS . 10.8 mmpt? -66.19 130.39 43.07 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.819 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -89.09 45.43 1.29 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.992 -177.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 425' ' ' SER . . . . . 0.503 ' HB2' HG12 ' A' ' 429' ' ' VAL . 24.6 m -77.59 116.53 18.22 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 176.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 46.3 tttp -76.0 -46.78 27.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.793 -172.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 21.3 m -82.76 49.24 1.45 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.692 0.282 . . . . 0.0 111.246 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 76.34 133.72 0.5 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.127 -0.558 . . . . 0.0 112.578 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.503 HG12 ' HB2' ' A' ' 425' ' ' SER . 15.4 m -80.53 127.23 76.42 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-O 120.958 0.408 . . . . 0.0 110.732 178.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 2.6 Cg_exo -75.37 49.66 2.42 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.291 2.66 . . . . 0.0 111.498 178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 8.1 p -80.0 39.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 121.711 0.767 . . . . 0.0 111.324 -175.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.4 m -78.6 53.34 1.31 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.69 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.747 ' HA ' HG21 ' A' ' 441' ' ' THR . 74.8 mt-30 -149.91 25.56 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.112 -178.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 434' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 437' ' ' ALA . 8.4 m -83.71 135.9 34.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.871 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -76.6 130.12 37.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.288 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 24.2 m 72.0 -59.23 0.56 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.392 0.677 . . . . 0.0 112.146 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.464 ' O ' ' HB ' ' A' ' 434' ' ' THR . . . -72.94 104.75 4.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.74 0.305 . . . . 0.0 110.78 179.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 69.16 46.28 58.63 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 -176.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -75.76 41.27 0.2 Allowed 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -177.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -72.19 -30.42 64.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.279 0.561 . . . . 0.0 110.258 175.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.747 HG21 ' HA ' ' A' ' 433' ' ' GLN . 1.4 t -63.73 -37.45 87.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.648 176.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 25.2 m -75.73 124.57 27.49 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.31 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -88.41 78.3 7.94 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 172.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -64.5 120.82 13.02 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.994 0.902 . . . . 0.0 111.026 -169.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -146.55 -39.06 0.22 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.311 -1.313 . . . . 0.0 108.127 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.686 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 42.5 m -71.6 -33.48 69.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.465 172.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -53.0 128.46 27.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.266 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 100.33 -22.76 38.59 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.023 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -71.04 137.46 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.959 0.409 . . . . 0.0 112.097 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.22 176.75 49.5 Favored Glycine 0 N--CA 1.444 -0.788 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 171.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -63.89 -43.4 96.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 117.193 0.497 . . . . 0.0 110.413 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 10.2 mptt -82.45 37.5 0.51 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.368 0.604 . . . . 0.0 111.016 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.73 -41.66 0.1 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.6 t -54.68 108.52 0.4 Allowed 'General case' 0 C--O 1.237 0.406 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.463 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.473 ' HB3' ' HB2' ' A' ' 458' ' ' ASP . 0.3 OUTLIER -71.11 126.97 31.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.108 178.44 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.524 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.6 m -67.55 -46.99 47.44 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.838 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 456' ' ' SER . 24.8 Cg_endo -61.83 -36.21 74.44 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.187 1.258 . . . . 0.0 111.772 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.473 ' HB2' ' HB3' ' A' ' 455' ' ' LYS . 9.3 m-20 -79.47 -39.82 31.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.177 -178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 10.3 m -133.35 -148.63 0.34 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.962 -171.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.537 ' HG3' ' HB2' ' A' ' 467' ' ' LYS . 9.9 ptpp? -167.51 149.13 5.63 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -97.94 133.19 42.76 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.506 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -139.86 122.69 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.41 -92.66 0.13 Allowed Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 -176.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -147.62 36.07 1.18 Allowed Glycine 0 N--CA 1.439 -1.147 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 1.9 p -140.62 144.15 35.59 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.293 0.568 . . . . 0.0 112.332 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.686 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 19.6 t -81.7 109.48 16.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.72 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.657 ' HE2' ' HA ' ' A' ' 467' ' ' LYS . 10.5 mmpt? -85.96 139.16 31.44 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.559 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.251 176.741 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.833 0 N-CA-C 111.88 -0.488 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 2.9 m -125.19 46.44 2.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.248 0.547 . . . . 0.0 110.767 -177.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -79.8 124.8 28.95 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -61.35 114.55 3.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.829 -176.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 425' ' ' SER . . . . . 0.851 ' HB2' ' HD3' ' A' ' 430' ' ' PRO . 43.5 t -173.81 137.62 0.6 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.512 -176.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -67.86 -43.3 79.78 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 176.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 73.8 m -169.14 139.32 2.23 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.016 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 108.79 -41.93 2.09 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.245 -0.979 . . . . 0.0 113.574 177.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.41 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 86.8 t 69.98 122.33 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 123.003 0.521 . . . . 0.0 110.998 -176.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.851 ' HD3' ' HB2' ' A' ' 425' ' ' SER . 52.2 Cg_exo -57.96 -53.18 4.64 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.941 2.427 . . . . 0.0 112.912 -176.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 34.5 m -86.06 9.12 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.769 0.319 . . . . 0.0 111.246 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 61.7 p 48.46 -141.33 0.59 Allowed 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.102 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 50.8 -95.4 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.292 0.637 . . . . 0.0 111.721 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 8.5 m 72.78 -58.29 0.6 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.628 0.771 . . . . 0.0 111.756 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -167.92 132.1 1.73 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 9.0 t -168.36 29.81 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.193 0.521 . . . . 0.0 110.474 -177.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.65 -48.86 35.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.171 176.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -87.82 -37.87 7.73 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.125 173.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 56.8 -141.7 0.79 Allowed 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.975 0.456 . . . . 0.0 110.675 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -127.39 40.33 3.72 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.642 0.734 . . . . 0.0 109.86 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.08 49.88 1.73 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.707 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.408 HG22 ' HB2' ' A' ' 444' ' ' GLU . 34.1 m 66.14 86.58 0.13 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.659 -176.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -75.64 42.12 0.22 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.212 178.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.481 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 13.3 tp10 -67.51 121.01 14.9 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.813 -178.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -74.53 -28.81 61.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.288 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.481 ' SG ' ' HG3' ' A' ' 444' ' ' GLU . 20.0 p -70.52 -30.85 67.73 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.3 tttm -61.43 105.24 0.49 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.592 173.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 136.74 -32.88 2.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.912 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 9.9 mmmm -65.76 142.45 57.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.273 . . . . 0.0 110.292 177.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.73 -176.85 22.46 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.141 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.53 -45.21 94.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.899 0.349 . . . . 0.0 111.19 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -71.29 -42.08 69.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 110.557 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.912 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.8 OUTLIER -65.03 -31.42 72.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.369 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.416 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 9.7 t -70.42 89.18 0.68 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.21 0.528 . . . . 0.0 109.736 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.418 ' HB3' ' HD2' ' A' ' 457' ' ' PRO . 97.2 mttt -83.97 147.4 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.189 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.476 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 15.4 m -60.77 -48.57 92.64 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 17.4 Cg_exo -64.66 -27.2 60.8 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.583 1.522 . . . . 0.0 111.487 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -82.47 -40.97 20.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.515 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.471 ' SG ' ' N ' ' A' ' 460' ' ' LYS . 22.1 t -162.99 -151.54 0.19 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.263 0.554 . . . . 0.0 111.103 -171.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.471 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 42.4 mmtm -147.2 127.67 14.07 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.577 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.416 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 67.0 t-105 -88.69 118.44 28.37 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -75.62 -72.21 0.33 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -178.2 41.09 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 155.32 -33.03 0.65 Allowed Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -176.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 28.0 m -132.46 136.89 47.01 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 120.874 0.369 . . . . 0.0 110.545 -179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 8.2 t -75.28 144.24 42.6 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -177.27 126.97 0.15 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.387 0.613 . . . . 0.0 111.229 -176.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.572 -178.321 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 111.596 -0.602 . . . . 0.0 111.596 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 422' ' ' THR . . . . . 0.427 ' HB ' ' H ' ' A' ' 423' ' ' LYS . 15.0 p -128.66 -143.02 0.26 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.649 0.224 . . . . 0.0 110.822 178.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 423' ' ' LYS . . . . . 0.427 ' H ' ' HB ' ' A' ' 422' ' ' THR . 58.1 mtpt -74.74 -36.2 62.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.791 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 62.11 38.61 13.71 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.594 0.711 . . . . 0.0 109.775 -174.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.82 133.11 44.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.297 -177.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -67.41 -36.94 82.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.802 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 6.7 m 57.88 42.1 23.64 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.453 178.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 75.45 -59.99 2.84 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.059 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 4.9 m -139.93 121.89 9.83 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-O 121.006 0.431 . . . . 0.0 110.186 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.05 135.02 33.54 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.505 2.136 . . . . 0.0 111.984 -178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 7.5 p -149.61 58.16 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 122.088 0.947 . . . . 0.0 109.368 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 3.4 m 74.92 139.13 0.06 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.566 -176.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -72.12 53.17 0.26 Allowed 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -175.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 434' ' ' THR . . . . . 0.759 ' HB ' ' HB2' ' A' ' 439' ' ' ALA . 8.4 t -97.38 50.78 1.07 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.918 0.866 . . . . 0.0 109.811 174.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -81.89 -123.91 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.56 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 7.3 m -62.75 -50.18 72.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.003 0.43 . . . . 0.0 110.032 175.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -83.77 147.37 27.64 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.229 173.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -64.16 146.53 50.41 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.184 -0.532 . . . . 0.0 112.522 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 439' ' ' ALA . . . . . 0.759 ' HB2' ' HB ' ' A' ' 434' ' ' THR . . . -64.44 142.75 58.31 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 122.152 0.181 . . . . 0.0 111.075 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -75.25 66.71 1.77 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.168 0.509 . . . . 0.0 110.644 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 7.3 t -69.18 -30.81 69.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.169 -177.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.0 m -56.01 121.76 10.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.808 -176.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -78.06 132.67 37.84 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.803 175.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.894 ' HA ' ' HB3' ' A' ' 447' ' ' LYS . 34.5 tt0 -98.2 37.31 1.46 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.663 0.744 . . . . 0.0 111.315 -175.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -85.82 -40.53 15.91 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 169.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 454' ' ' CYS . 17.4 m -93.38 -33.86 13.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.12 174.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.894 ' HB3' ' HA ' ' A' ' 444' ' ' GLU . 16.1 tppt? -58.6 117.36 4.45 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 178.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 121.03 -28.99 5.91 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.969 -175.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -73.1 146.5 45.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.683 0.277 . . . . 0.0 111.339 -179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -81.76 173.72 53.81 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.59 173.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -63.6 -33.16 75.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -83.12 35.47 0.49 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.257 0.551 . . . . 0.0 111.269 177.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -160.08 -50.92 0.05 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.631 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.5 OUTLIER -72.46 120.6 18.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.027 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.495 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 16.4 ptpt -75.39 122.03 23.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.314 178.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 456' ' ' SER . . . . . . . . . . . . . 21.1 m -69.57 -44.78 25.42 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -173.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.22 -40.61 81.38 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.179 1.253 . . . . 0.0 111.531 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.495 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 27.5 t70 -80.68 -43.46 20.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.753 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 88.3 m -121.6 133.88 55.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.164 0.507 . . . . 0.0 111.233 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.673 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 46.4 mttt -64.73 138.57 58.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.096 -176.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.45 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 61.3 t-105 -119.31 129.44 54.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.317 175.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -170.15 131.97 1.03 Allowed 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.214 0.321 . . . . 0.0 110.717 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 63.34 36.82 93.91 Favored Glycine 0 CA--C 1.517 0.192 0 CA-C-N 116.173 -0.467 . . . . 0.0 113.256 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.14 39.76 97.59 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.768 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.4 t -161.77 139.92 9.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.45 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 1.6 t -91.79 144.12 25.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.185 -176.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.673 ' HG2' ' HB2' ' A' ' 460' ' ' LYS . 0.0 OUTLIER -149.42 146.86 27.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.647 0.26 . . . . 0.0 110.811 -178.129 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 50.1 t0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.688 -0.672 . . . . 0.0 109.593 179.501 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.719 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.7 t -162.76 143.64 9.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.552 0.176 . . . . 0.0 110.64 -176.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 64.1 tttp 73.43 -51.81 0.7 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.792 0.837 . . . . 0.0 111.772 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 56.78 60.35 3.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.984 0.421 . . . . 0.0 111.28 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.7 m -60.27 137.77 58.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.752 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -79.5 55.55 1.98 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.347 0.594 . . . . 0.0 110.543 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 54.2 m -158.53 139.77 13.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.247 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -158.93 45.7 0.45 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.805 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.757 ' HB ' ' HD3' ' A' ' 430' ' ' PRO . 26.0 t -69.97 -56.5 7.31 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.757 ' HD3' ' HB ' ' A' ' 429' ' ' VAL . 17.8 Cg_endo -99.23 -142.96 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 123.996 3.131 . . . . 0.0 112.547 -176.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.4 ' H ' ' HB2' ' A' ' 430' ' ' PRO . 15.1 t 55.9 55.56 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.646 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 15.5 m 73.21 130.4 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.536 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -73.94 55.14 0.54 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.995 -174.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 35.0 p -81.01 -55.36 4.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.168 0.508 . . . . 0.0 110.092 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -87.97 -43.47 11.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.855 174.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.1 m 61.21 42.49 12.07 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.88 178.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 70.15 -47.42 0.62 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.603 0.761 . . . . 0.0 112.406 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 115.1 130.84 4.9 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.076 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 68.6 130.15 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.586 0.754 . . . . 0.0 112.14 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -81.34 144.21 31.65 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.493 177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 37.9 m -59.51 -38.16 80.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.927 0.394 . . . . 0.0 110.5 176.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 4.1 m -77.2 113.36 14.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.453 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -138.91 -29.46 0.77 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.835 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.572 ' HG2' ' H ' ' A' ' 468' ' ' ASP . 1.3 pp20? -41.4 133.34 2.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.898 -1.047 . . . . 0.0 113.073 -172.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -78.17 7.65 5.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.869 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.713 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 90.1 m -70.76 -36.18 72.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.024 175.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -52.78 115.35 1.78 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.787 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 122.4 -28.48 5.76 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.587 -176.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.697 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 22.5 mtmm -80.41 138.26 36.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.578 0.227 . . . . 0.0 111.474 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -76.64 -169.79 30.69 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -62.67 -46.04 90.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.95 0.375 . . . . 0.0 111.539 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -64.3 -34.19 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 111.045 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.2 -40.32 27.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.876 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 14.7 t -58.65 114.09 2.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.958 -177.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.845 ' HE3' ' HA ' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -87.51 125.39 34.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.019 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.543 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 m -60.8 -49.03 91.24 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.6 Cg_endo -60.11 -26.74 83.3 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.022 1.815 . . . . 0.0 112.078 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -87.85 -45.34 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.924 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 68.9 m -146.27 152.65 39.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.271 0.558 . . . . 0.0 111.63 -176.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.1 131.84 35.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.3 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -78.71 113.55 16.87 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -74.58 -47.26 33.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.006 0.431 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.71 -46.47 0.18 Allowed Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.226 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -140.07 31.53 2.26 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 177.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.7 t -170.94 145.31 2.32 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.026 0.441 . . . . 0.0 110.242 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.713 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 12.3 t -87.7 132.23 34.19 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.42 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 0.0 OUTLIER -158.29 153.19 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.838 -171.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.572 ' H ' ' HG2' ' A' ' 444' ' ' GLU . 28.2 t70 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.887 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 111.757 -0.537 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 13.5 t -152.07 32.72 0.53 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.529 0.68 . . . . 0.0 109.686 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 423' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 423' ' ' LYS . 0.2 OUTLIER 58.08 37.55 26.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.46 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -79.09 -58.28 3.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.99 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.2 m -104.19 -150.56 0.42 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.178 173.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -73.42 106.78 5.37 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 173.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 2.6 p -167.61 130.27 1.63 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.499 -175.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -74.55 -135.58 0.38 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.054 -0.594 . . . . 0.0 113.032 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 9.4 p -156.77 136.83 8.71 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -177.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.478 ' HB3' ' HB ' ' A' ' 434' ' ' THR . 51.9 Cg_exo -54.27 -43.53 57.74 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.564 2.176 . . . . 0.0 111.826 -178.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 8.0 p 43.64 50.86 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.213 1.005 . . . . 0.0 112.588 174.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 2.5 m 60.33 34.67 20.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.729 0.776 . . . . 0.0 110.486 176.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -155.8 46.56 0.48 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.254 -0.885 . . . . 0.0 108.669 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 434' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 430' ' ' PRO . 5.5 t -79.81 67.94 5.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.946 -176.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -63.69 -51.19 66.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.583 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 4.1 m 56.69 43.15 25.83 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.952 0.882 . . . . 0.0 110.522 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -84.62 -42.87 14.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.008 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 75.65 39.49 34.43 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.06 -175.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -152.92 39.01 0.52 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.291 0.567 . . . . 0.0 110.261 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -144.95 50.61 1.25 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.667 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 52.4 m -55.97 -42.89 76.97 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.079 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.58 HG22 ' CG ' ' A' ' 444' ' ' GLU . 22.8 m 71.72 -47.28 0.66 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.341 173.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 61.47 26.68 16.39 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.666 0.746 . . . . 0.0 110.606 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.58 ' CG ' HG22 ' A' ' 442' ' ' THR . 9.6 pt-20 -161.05 43.86 0.17 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.353 173.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -63.25 -27.68 69.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.892 174.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.513 ' SG ' ' HE2' ' A' ' 449' ' ' LYS . 3.6 t -69.9 -8.59 49.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.91 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 466' ' ' CYS . 55.0 tttm -59.37 128.82 39.01 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.361 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.05 -34.6 2.51 Favored Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -176.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.627 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 49.2 mtmt -76.63 139.86 40.76 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 177.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -66.95 174.51 25.44 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.85 -0.691 . . . . 0.0 111.45 176.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -58.01 -37.29 74.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.21 -43.48 74.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.383 . . . . 0.0 110.684 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.627 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 3.6 m-20 -72.07 -39.97 68.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.718 -179.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -73.97 71.22 1.55 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.92 176.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.77 ' HG3' ' HD2' ' A' ' 457' ' ' PRO . 20.7 tptm -64.29 135.06 55.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.53 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.551 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 37.2 m -53.72 -51.94 71.95 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -173.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.77 ' HD2' ' HG3' ' A' ' 455' ' ' LYS . 36.2 Cg_exo -61.18 -32.85 91.22 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 121.582 1.521 . . . . 0.0 111.553 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -77.58 -44.7 27.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.727 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 96.9 m -149.71 147.47 28.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 0.0 110.843 -175.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.722 ' HB2' ' HG3' ' A' ' 467' ' ' LYS . 49.4 mmtm -79.19 129.86 34.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.452 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -107.79 125.84 51.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.522 ' HB2' ' NZ ' ' A' ' 467' ' ' LYS . 12.7 tp10 -86.75 -131.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 463' ' ' GLY . . . . . 0.451 ' H ' ' HG3' ' A' ' 462' ' ' GLU . . . -82.3 -41.11 9.48 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.443 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -159.08 45.4 0.45 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.43 ' OG1' ' HE2' ' A' ' 447' ' ' LYS . 9.6 t -163.4 136.73 5.63 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.547 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 447' ' ' LYS . 11.2 t -90.01 145.86 24.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.959 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.722 ' HG3' ' HB2' ' A' ' 460' ' ' LYS . 9.4 ptpp? -144.88 160.48 41.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.666 0.269 . . . . 0.0 110.391 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.736 -0.65 . . . . 0.0 110.821 -176.977 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.772 0 N-CA-C 111.762 -0.535 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 18.4 m 66.54 73.91 0.35 Allowed 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.246 0.546 . . . . 0.0 110.383 -177.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -66.75 112.73 4.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.846 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -165.94 -95.35 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.04 178.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 23.2 t -67.2 -41.23 86.16 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -100.68 129.94 46.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.208 176.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 48.8 m -155.62 142.79 19.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.954 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 173.28 -125.78 1.17 Allowed Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 -177.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.558 ' HB ' HG23 ' A' ' 431' ' ' VAL . 29.0 m 44.26 107.25 0.01 OUTLIER Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 124.73 1.212 . . . . 0.0 113.59 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.67 52.04 3.19 Favored 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 123.372 2.715 . . . . 0.0 112.063 177.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.777 HG21 HG23 ' A' ' 441' ' ' THR . 2.5 t -95.7 28.87 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.292 0.568 . . . . 0.0 110.164 -178.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 15.4 m -76.71 -47.91 20.46 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.584 177.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -158.51 50.34 0.39 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.138 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 32.3 m -155.18 100.59 2.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.489 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 435' ' ' GLN . . . . . 0.698 ' HA ' ' HB2' ' A' ' 440' ' ' ASP . 23.5 mp0 -128.69 152.94 47.83 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.185 -175.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 3.1 m -54.52 -62.96 1.31 Allowed 'General case' 0 CA--C 1.532 0.26 0 O-C-N 123.277 0.36 . . . . 0.0 111.164 -176.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -162.93 31.23 0.1 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.323 0.582 . . . . 0.0 110.383 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 161.3 -40.12 0.41 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.482 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -160.41 131.09 5.48 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 440' ' ' ASP . . . . . 0.698 ' HB2' ' HA ' ' A' ' 435' ' ' GLN . 38.4 t70 -87.69 -43.0 12.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.281 0.562 . . . . 0.0 110.021 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.777 HG23 HG21 ' A' ' 431' ' ' VAL . 7.8 p -82.54 120.17 25.17 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.399 172.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.72 HG22 ' HG2' ' A' ' 444' ' ' GLU . 37.8 m -69.65 117.75 11.64 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.93 -175.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -79.36 48.95 0.93 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.087 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.871 ' HB2' ' HB2' ' A' ' 447' ' ' LYS . 51.6 mm-40 -58.59 121.44 10.96 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.32 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 445' ' ' LYS . 37.1 ttpt -58.41 -30.7 67.07 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.738 0.78 . . . . 0.0 109.208 173.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.674 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.0 m -79.02 -22.25 45.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.332 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.871 ' HB2' ' HB2' ' A' ' 444' ' ' GLU . 47.3 tptt -53.52 133.01 41.1 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 68.01 33.76 80.01 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.115 -0.948 . . . . 0.0 114.529 171.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.674 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 46.8 mtmt -119.44 147.47 44.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.444 0.622 . . . . 0.0 110.626 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.36 155.48 53.05 Favored Glycine 0 C--O 1.225 -0.409 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.8 -33.99 67.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.297 0.548 . . . . 0.0 111.361 -177.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -57.02 -40.91 77.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.968 0.414 . . . . 0.0 110.535 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.555 ' OD2' ' HD2' ' A' ' 449' ' ' LYS . 33.5 t70 -91.57 -49.18 6.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.061 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.575 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.8 OUTLIER -73.21 92.88 1.79 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 111.832 -177.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -152.7 135.04 15.06 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.58 ' C ' ' H ' ' A' ' 458' ' ' ASP . 2.8 t -167.36 149.99 5.69 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.617 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -73.74 26.07 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.395 2.064 . . . . 0.0 109.798 172.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.58 ' H ' ' C ' ' A' ' 456' ' ' SER . 35.2 t70 -151.5 -43.23 0.11 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.569 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 456' ' ' SER . 73.8 m -71.75 138.87 48.77 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.393 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.409 ' HB3' ' NZ ' ' A' ' 460' ' ' LYS . 6.2 ttpm? -113.3 137.42 51.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.861 0.362 . . . . 0.0 110.719 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.759 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 58.7 t-105 -95.84 122.33 38.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.745 177.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.587 ' HG3' ' HE3' ' A' ' 467' ' ' LYS . 48.0 mm-40 -82.4 -38.43 24.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.186 0.517 . . . . 0.0 110.822 -178.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 155.49 -50.31 0.46 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -134.57 29.85 2.95 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 174.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.3 t -175.0 145.18 0.8 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.109 -0.545 . . . . 0.0 109.727 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.759 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 15.8 t -112.76 132.6 55.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.375 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.587 ' HE3' ' HG3' ' A' ' 462' ' ' GLU . 22.4 pttp -178.12 142.67 0.28 Allowed 'General case' 0 C--O 1.233 0.209 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 40.2 t0 . . . . . 0 C--O 1.253 1.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.914 175.94 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.746 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 10.0 t -155.17 136.9 14.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.888 0.375 . . . . 0.0 109.997 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -73.33 130.85 41.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.635 -177.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.591 ' HB3' ' HB2' ' A' ' 427' ' ' SER . . . -83.52 161.6 21.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.143 175.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 7.5 p -74.86 36.61 0.11 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp 178.71 -47.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 427' ' ' SER . . . . . 0.591 ' HB2' ' HB3' ' A' ' 424' ' ' ALA . 20.1 m -59.68 138.34 57.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.324 -177.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 125.86 -53.68 0.77 Allowed Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.351 -1.1 . . . . 0.0 110.351 -174.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 35.6 t 56.37 99.58 0.04 OUTLIER Pre-proline 0 C--O 1.235 0.33 0 C-N-CA 123.234 0.614 . . . . 0.0 112.216 173.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -68.53 122.52 9.5 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.338 2.025 . . . . 0.0 110.057 174.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.415 HG12 ' H ' ' A' ' 434' ' ' THR . 21.5 t -72.07 111.24 5.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.004 0.43 . . . . 0.0 110.098 -176.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 27.6 m -85.76 -45.62 11.45 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.17 -175.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -69.18 -52.67 25.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.889 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 434' ' ' THR . . . . . 0.415 ' H ' HG12 ' A' ' 431' ' ' VAL . 1.9 p 50.13 62.68 2.54 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.091 0.472 . . . . 0.0 110.635 -175.726 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 64.12 -131.85 0.36 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.303 -175.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 4.7 p -69.47 94.91 0.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.887 0.375 . . . . 0.0 111.231 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.8 137.75 44.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.041 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 62.83 -123.68 30.93 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.475 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -156.58 -136.62 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 2.8 p30 43.81 34.99 0.97 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.038 0.935 . . . . 0.0 112.899 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 15.2 t -90.73 129.35 36.83 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.056 0.455 . . . . 0.0 110.12 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.436 HG23 ' H ' ' A' ' 445' ' ' LYS . 10.3 t -170.01 -151.92 0.09 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.27 -176.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -67.27 -53.86 26.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.754 0.312 . . . . 0.0 110.673 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -168.12 47.5 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.932 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.445 ' HG3' ' HB3' ' A' ' 468' ' ' ASP . 0.0 OUTLIER 66.42 30.48 8.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.653 177.73 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.584 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 85.2 m 63.48 20.99 12.55 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.324 175.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -78.73 134.73 37.04 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.808 -177.225 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.7 32.82 35.98 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.509 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -113.51 143.12 45.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.45 163.76 52.91 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.604 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.63 -40.38 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.151 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 12.5 mptt -74.39 -34.6 63.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -71.61 -45.48 61.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 0.0 110.03 177.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.465 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.1 t -60.45 133.08 55.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.179 176.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 455' ' ' LYS . 30.7 mmtp -128.7 134.4 48.47 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.554 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 8.7 m -54.37 -50.74 83.3 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -173.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.554 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 31.9 Cg_exo -59.02 -28.22 87.25 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.824 1.683 . . . . 0.0 111.267 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -81.22 -54.58 5.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.548 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 95.1 m -155.8 158.88 38.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.101 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -89.37 137.67 32.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.939 0.4 . . . . 0.0 111.459 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.465 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 66.3 t-105 -89.25 117.99 28.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.66 174.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.51 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 6.0 mm-40 -119.05 116.62 26.78 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.958 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 66.15 -66.75 0.14 Allowed Glycine 0 C--N 1.333 0.385 0 O-C-N 123.807 0.692 . . . . 0.0 113.476 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -170.36 38.58 0.19 Allowed Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.403 HG23 ' HE3' ' A' ' 467' ' ' LYS . 14.5 t -159.8 139.98 11.79 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.584 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.7 t -94.82 139.03 31.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -174.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.51 ' HD3' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -155.55 151.87 28.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.34 . . . . 0.0 111.147 -177.568 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.445 ' HB3' ' HG3' ' A' ' 445' ' ' LYS . 10.1 p-10 . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.781 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.96 0 N-CA-C 112.405 -0.278 . . . . 0.0 112.405 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 14.4 t -148.78 -174.24 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp 72.07 142.16 0.06 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.632 0.583 . . . . 0.0 111.015 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -57.58 140.62 50.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.251 -178.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 24.3 m -59.48 129.13 40.49 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.805 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -175.5 -46.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.59 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 15.0 m -65.88 -35.61 81.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.373 -178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 83.35 -127.77 8.19 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.347 -175.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 6.1 p -151.59 126.09 4.57 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-O 120.907 0.384 . . . . 0.0 110.545 178.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.66 -39.65 20.21 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.537 2.158 . . . . 0.0 111.452 -178.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.59 131.2 33.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.945 176.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 6.1 m -60.31 124.14 19.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.603 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -156.72 -57.41 0.09 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.257 -177.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 1.7 p -85.0 -69.11 0.67 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.756 -175.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 88.4 mm-40 67.13 -63.47 0.28 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.644 0.778 . . . . 0.0 111.966 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 71.1 p 51.02 -139.36 0.95 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.508 0.723 . . . . 0.0 111.096 -178.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 64.4 157.86 0.09 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.29 0.567 . . . . 0.0 112.164 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 179.81 135.28 2.4 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.65 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -105.26 46.45 0.92 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 35.5 t70 72.38 120.19 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.529 -177.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 11.6 m -75.01 -57.07 4.13 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.14 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.2 m -162.95 114.93 1.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.115 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -77.83 127.61 32.68 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 447' ' ' LYS . 35.1 mt-10 -78.42 67.69 4.26 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.075 0.464 . . . . 0.0 111.415 -176.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -69.14 -15.29 63.38 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.972 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.579 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 24.9 p -166.86 -31.59 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.932 -174.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.674 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 60.2 tttm -43.75 120.0 1.87 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.826 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.99 -32.83 5.31 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -61.58 152.81 29.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.009 0.433 . . . . 0.0 111.809 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.48 166.52 54.61 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.045 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -55.3 -50.76 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 26.5 tttm -63.85 -43.0 97.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.835 0.35 . . . . 0.0 110.801 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -67.19 -42.91 83.41 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.709 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.427 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 12.1 t -60.45 105.68 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.2 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 455' ' ' LYS . 38.7 mmtm -165.38 43.58 0.08 Allowed 'General case' 0 CA--C 1.498 -1.032 0 CA-C-O 121.854 0.835 . . . . 0.0 108.928 176.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.712 ' HB2' ' CB ' ' A' ' 459' ' ' CYS . 50.3 m -72.19 135.12 82.41 Favored Pre-proline 0 C--N 1.296 -1.737 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.935 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.75 24.44 0.29 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.559 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.685 ' H ' ' C ' ' A' ' 456' ' ' SER . 46.0 t0 -148.69 -27.86 0.3 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 112.818 -1.992 . . . . 0.0 108.84 -176.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.712 ' CB ' ' HB2' ' A' ' 456' ' ' SER . 13.7 t -88.49 -174.77 4.72 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.039 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.466 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 5.4 mmmm -158.41 135.02 9.55 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.356 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.427 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 56.3 t-105 -85.79 122.21 29.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -156.68 130.01 8.05 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.894 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.99 36.76 92.45 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.298 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.62 82.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.604 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -157.9 142.45 16.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.357 0.598 . . . . 0.0 110.945 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.674 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 5.5 t -79.32 142.1 36.4 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.1 pttp 178.07 137.87 0.08 Allowed 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.048 0.451 . . . . 0.0 111.217 -177.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 54.1 t0 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.506 -0.759 . . . . 0.0 109.446 174.926 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.874 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.52 129.68 38.49 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.932 0.366 . . . . 0.0 111.242 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 52.6 tttm 71.26 -54.16 0.67 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.164 0.986 . . . . 0.0 112.375 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -87.25 -163.56 0.94 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.575 0.226 . . . . 0.0 111.257 -178.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 6.5 t 59.48 37.24 23.04 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.721 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -93.81 142.47 27.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.479 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.2 t -162.6 41.17 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.593 0.711 . . . . 0.0 109.21 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 165.81 147.63 5.24 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.869 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.403 HG12 HG13 ' A' ' 431' ' ' VAL . 67.1 t 69.89 112.38 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.453 0 CA-C-O 121.277 0.56 . . . . 0.0 111.221 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -82.17 44.8 1.78 Allowed 'Trans proline' 0 CA--C 1.53 0.286 0 C-N-CA 123.007 2.471 . . . . 0.0 113.663 -176.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.403 HG13 HG12 ' A' ' 429' ' ' VAL . 3.1 m -75.97 129.83 36.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.786 0.326 . . . . 0.0 110.927 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 432' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 433' ' ' GLN . 7.0 t 177.67 -31.0 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.438 -178.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 432' ' ' THR . 68.8 mt-30 73.74 -58.19 0.6 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.705 0.802 . . . . 0.0 111.327 -178.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.6 t -83.06 60.06 5.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 122.04 0.924 . . . . 0.0 110.36 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -62.48 -49.97 73.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.186 -0.916 . . . . 0.0 111.426 -176.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 436' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 439' ' ' ALA . 11.5 p -71.17 -51.87 22.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.249 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 69.66 -53.61 0.61 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.655 0.782 . . . . 0.0 111.935 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -99.49 40.84 2.33 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.978 -0.63 . . . . 0.0 112.044 177.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 439' ' ' ALA . . . . . 0.473 ' HB3' ' HB ' ' A' ' 436' ' ' THR . . . -171.41 123.49 0.56 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 110.146 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -72.55 -34.3 67.43 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.759 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 22.1 p 50.86 46.69 25.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.585 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.5 m -81.95 -35.9 28.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.899 174.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 57.1 -116.9 1.0 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.528 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -118.06 43.13 2.51 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.074 0.464 . . . . 0.0 110.863 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -72.53 -34.21 67.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.359 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 79.3 m -76.07 -42.7 46.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.093 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -58.9 126.46 27.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.427 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 120.44 -31.44 5.24 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.597 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -70.09 139.48 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.751 0.31 . . . . 0.0 111.329 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.37 165.34 54.32 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.42 -48.36 71.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.179 0.489 . . . . 0.0 111.692 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -67.56 -34.47 77.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.033 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -74.0 -44.32 54.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.853 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.0 t -54.99 119.26 5.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.124 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -90.38 123.64 34.28 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.492 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 28.2 t -57.19 -49.3 94.7 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 39.7 Cg_exo -60.57 -29.94 89.58 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 121.854 1.702 . . . . 0.0 111.786 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -82.32 -49.12 10.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.116 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 20.2 m -140.81 135.95 31.94 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -80.08 122.57 26.94 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.979 0.418 . . . . 0.0 110.484 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.482 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 68.6 t-105 -84.3 126.37 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.46 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 8.9 tt0 -156.97 133.3 9.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.604 0.24 . . . . 0.0 110.734 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.25 34.53 89.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.514 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.18 37.68 95.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.818 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 13.3 t -155.87 141.81 18.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.429 . . . . 0.0 110.314 177.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.482 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 30.9 t -89.05 126.52 35.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.812 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 63.5 pttt -144.25 139.85 28.9 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.805 0.336 . . . . 0.0 110.473 -178.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.423 ' HB3' ' SG ' ' A' ' 446' ' ' CYS . 3.3 p30 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.636 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.707 0 N-CA-C 111.844 -0.503 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.3 m -77.34 59.92 1.92 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.567 0.698 . . . . 0.0 111.529 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -122.35 34.65 5.09 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.923 178.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -168.75 48.53 0.04 OUTLIER 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.343 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 44.1 m -59.51 130.11 45.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.234 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -66.68 -51.22 58.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.3 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 35.8 p 47.32 39.23 8.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.804 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -87.61 -45.28 5.26 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.625 178.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 3.4 p -162.71 123.64 1.52 Allowed Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 22.9 Cg_exo -68.65 128.69 17.46 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.66 2.24 . . . . 0.0 112.481 -175.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 33.4 m -85.91 -4.83 9.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.708 0.766 . . . . 0.0 110.373 176.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.2 p -72.22 135.99 46.24 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 114.701 -1.136 . . . . 0.0 111.214 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -62.52 131.98 50.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.97 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 31.5 m -58.7 -46.75 86.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.637 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -166.1 126.57 1.73 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.753 174.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 10.2 t -65.24 125.46 25.11 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.027 0.442 . . . . 0.0 110.473 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -169.15 142.73 2.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.98 -176.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 79.73 41.71 12.41 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.505 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -67.42 -34.4 77.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.789 0.328 . . . . 0.0 110.552 177.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 38.7 t70 62.16 52.24 3.28 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.042 -178.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 35.6 m -155.09 120.78 5.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.427 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 32.5 m -78.75 119.71 22.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.328 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -75.57 -27.18 58.48 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.884 178.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.431 ' C ' ' H ' ' A' ' 446' ' ' CYS . 6.2 tp10 -45.6 125.64 6.07 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.647 -173.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.42 ' O ' ' HE2' ' A' ' 449' ' ' LYS . 15.3 ttmm -74.16 42.4 0.15 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.522 -178.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.431 ' H ' ' C ' ' A' ' 444' ' ' GLU . 58.1 m -145.58 5.42 1.05 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.739 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -78.01 106.81 10.13 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.302 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 59.07 47.39 91.03 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.326 -0.852 . . . . 0.0 114.067 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.8 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 26.9 mtmt -107.55 -169.38 1.52 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.296 0.548 . . . . 0.0 110.25 174.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.44 154.1 36.08 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.29 -35.58 75.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.925 0.363 . . . . 0.0 110.453 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -57.77 -48.37 79.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.412 177.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.625 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.4 OUTLIER -68.92 -54.58 14.66 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.093 176.529 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.8 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 27.6 m -70.98 96.15 1.26 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.014 -0.994 . . . . 0.0 112.826 -174.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -145.9 142.51 28.83 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.561 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.569 ' C ' ' H ' ' A' ' 458' ' ' ASP . 3.3 t 174.71 149.26 0.25 Allowed Pre-proline 0 C--N 1.317 -0.814 0 O-C-N 124.138 0.899 . . . . 0.0 109.113 -178.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.76 27.88 0.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.268 1.979 . . . . 0.0 109.945 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.569 ' H ' ' C ' ' A' ' 456' ' ' SER . 11.6 t70 -150.58 -43.36 0.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.961 -177.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 456' ' ' SER . 62.1 m -68.56 134.32 49.84 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 174.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -125.34 149.76 47.81 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.848 -175.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.514 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 29.7 t-105 -101.49 131.03 47.84 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.667 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.591 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 40.0 tp10 -158.73 122.08 3.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.821 0.343 . . . . 0.0 110.905 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.37 41.55 98.07 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.52 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.1 41.85 99.67 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.12 -0.562 . . . . 0.0 112.764 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -169.97 147.86 3.36 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.06 0.457 . . . . 0.0 110.451 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.514 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.6 OUTLIER -95.27 145.42 25.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.255 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.591 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 62.3 pttt -157.25 149.05 22.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.049 0.452 . . . . 0.0 111.933 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 59.9 t0 . . . . . 0 C--O 1.248 1.009 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.103 174.723 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.625 0 N-CA-C 112.083 -0.407 . . . . 0.0 112.083 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 3.4 m 59.28 48.95 9.57 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.196 0.522 . . . . 0.0 110.828 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 423' ' ' LYS . . . . . 0.71 ' HA ' ' HA2' ' A' ' 428' ' ' GLY . 0.0 OUTLIER -165.38 145.02 6.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.734 176.702 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -151.65 -63.53 0.18 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.008 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 31.1 t -170.09 -55.48 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -80.61 -43.4 20.59 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -173.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.8 t -171.59 69.52 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.989 0.423 . . . . 0.0 111.112 -176.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 428' ' ' GLY . . . . . 0.71 ' HA2' ' HA ' ' A' ' 423' ' ' LYS . . . 66.93 -127.49 27.85 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.215 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.665 HG22 ' H ' ' A' ' 431' ' ' VAL . 5.1 p -64.83 124.04 85.3 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-O 120.927 0.394 . . . . 0.0 110.036 176.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -79.66 1.43 9.22 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.61 2.207 . . . . 0.0 112.694 -176.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.665 ' H ' HG22 ' A' ' 429' ' ' VAL . 32.7 m 43.51 42.34 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.234 1.014 . . . . 0.0 112.097 -178.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 5.6 m -66.53 136.53 55.79 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.291 -178.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -151.06 -41.42 0.12 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.692 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 5.2 p -81.16 37.73 0.45 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.821 0.343 . . . . 0.0 111.754 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -139.71 90.39 2.39 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 175.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 5.1 m -136.71 140.9 42.98 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.47 -175.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 64.47 45.59 3.64 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 123.659 0.6 . . . . 0.0 111.478 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 64.13 49.24 68.04 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.865 177.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -69.41 132.37 46.24 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 178.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -63.84 115.32 4.72 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.832 0.349 . . . . 0.0 110.753 -178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 7.0 p -77.74 123.76 27.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.775 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.659 ' HA ' ' HB3' ' A' ' 468' ' ' ASP . 14.6 m -160.87 -51.75 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.427 178.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 56.14 35.71 26.14 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.025 0.44 . . . . 0.0 111.167 -178.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 51.79 35.49 15.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.729 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 442' ' ' THR . 0.0 OUTLIER -77.26 -33.18 55.95 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.744 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.495 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 67.5 m -148.79 18.8 1.01 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.781 -179.122 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -71.32 118.33 13.99 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.535 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.76 23.97 61.12 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.499 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 23.1 ttmm -90.41 138.4 31.57 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -71.19 164.62 53.7 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.741 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.13 -37.91 78.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 117.013 0.406 . . . . 0.0 111.783 -177.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -74.66 -39.61 61.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.825 0.345 . . . . 0.0 110.599 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -70.05 -40.69 74.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.797 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.532 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.0 t -61.53 125.97 25.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.624 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.462 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 7.8 ptpp? -124.79 132.28 53.36 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.333 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.517 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.5 m -52.83 -47.95 93.05 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -59.51 -25.93 80.35 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.718 1.612 . . . . 0.0 111.94 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.462 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 26.0 t70 -92.99 -46.56 7.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.52 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.508 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 85.4 m -147.23 156.34 42.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 110.83 -178.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -90.03 120.27 31.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.64 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.532 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 70.6 t-105 -81.69 117.56 22.12 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -84.03 -37.65 21.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.02 0.438 . . . . 0.0 110.499 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 166.74 -46.03 0.26 Allowed Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.342 -0.703 . . . . 0.0 111.342 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -131.67 -10.3 2.36 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 11.2 m -130.26 136.03 48.74 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.967 0.413 . . . . 0.0 110.7 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 18.2 t -92.46 119.86 32.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.437 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.27 133.21 49.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.052 -175.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.659 ' HB3' ' HA ' ' A' ' 442' ' ' THR . 35.2 t70 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.576 -0.726 . . . . 0.0 110.869 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 3.6 m -69.17 -35.34 76.18 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.318 0.58 . . . . 0.0 110.414 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -111.93 49.12 0.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.062 176.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -161.16 136.54 7.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.434 -178.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.6 t -173.34 -133.59 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -44.52 88.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 29.0 t -77.99 146.48 35.39 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.248 175.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -149.91 -61.72 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 177.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 56.8 t -100.95 111.34 63.16 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 170.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -71.44 120.05 6.68 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.326 2.017 . . . . 0.0 112.167 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 35.8 m -84.94 35.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.386 0.612 . . . . 0.0 110.791 177.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 19.7 m -65.5 137.82 57.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.514 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -73.3 58.55 0.54 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.196 0.522 . . . . 0.0 110.576 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 20.0 m -160.56 -46.78 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.487 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -84.66 44.14 1.03 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.938 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.4 m -114.83 40.28 2.65 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.489 0.662 . . . . 0.0 109.996 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -74.65 143.24 44.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.162 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -87.12 47.39 3.67 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.043 -0.599 . . . . 0.0 111.937 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -85.05 57.06 4.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.737 0.303 . . . . 0.0 111.319 -177.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 44.0 t0 60.67 40.88 15.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.437 0.637 . . . . 0.0 110.441 -178.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 36.2 m -72.59 -39.74 67.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.393 176.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.686 HG21 ' HB2' ' A' ' 468' ' ' ASP . 7.4 m -151.45 158.28 43.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.335 177.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -61.09 -28.97 69.47 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.905 0.383 . . . . 0.0 110.335 177.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.618 ' HA ' ' OD1' ' A' ' 468' ' ' ASP . 78.6 mt-10 68.28 62.09 0.38 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.884 176.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.39 -29.1 24.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.49 -0.777 . . . . 0.0 108.918 172.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.447 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 76.7 m -79.48 -34.84 41.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.791 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -48.38 122.34 5.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.924 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 61.35 33.51 84.82 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.411 -0.813 . . . . 0.0 113.907 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.749 ' HD3' ' HA ' ' A' ' 454' ' ' CYS . 18.2 ptmt -85.31 -19.94 30.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.174 0.487 . . . . 0.0 110.954 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 103.65 150.78 21.88 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.806 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 451' ' ' GLU . . . . . 0.414 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 29.1 tt0 -63.37 -43.1 98.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 122.455 0.302 . . . . 0.0 111.44 -175.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.52 42.04 0.81 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.365 0.603 . . . . 0.0 110.563 177.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -160.62 -38.14 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.445 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 449' ' ' LYS . 19.9 t -74.49 73.98 1.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.09 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.5 132.83 47.65 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.3 m -50.19 -50.31 70.77 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -171.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 456' ' ' SER . 20.2 Cg_endo -61.6 -31.61 87.07 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.839 1.693 . . . . 0.0 111.688 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -83.29 -44.1 15.29 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.4 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.21 146.3 26.75 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -86.26 128.34 34.9 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.706 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.617 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 64.8 t-105 -96.13 111.15 23.27 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 174.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -82.88 47.11 1.16 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.978 0.418 . . . . 0.0 110.971 -176.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 57.95 38.13 87.78 Favored Glycine 0 C--N 1.33 0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.688 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 152.47 -37.48 0.79 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.179 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 24.4 m -123.16 129.16 51.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.201 . . . . 0.0 111.218 -177.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.617 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 23.2 t -82.01 138.06 34.97 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.33 141.43 32.36 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.01 0.433 . . . . 0.0 110.754 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.686 ' HB2' HG21 ' A' ' 442' ' ' THR . 1.8 m-20 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.994 -178.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.633 0 N-CA-C 111.737 -0.545 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.4 t -66.0 141.98 57.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.869 0.366 . . . . 0.0 110.345 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -154.41 46.87 0.58 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.768 0.794 . . . . 0.0 109.32 -177.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -73.76 125.81 28.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.693 -178.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 56.3 m -75.74 120.63 21.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.752 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -72.72 -37.5 67.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.248 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 49.4 m 66.97 123.86 0.02 OUTLIER 'General case' 0 C--O 1.235 0.322 0 O-C-N 124.072 0.857 . . . . 0.0 111.731 177.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 179.55 124.16 0.87 Allowed Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.233 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 35.4 m -73.46 135.8 78.58 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-O 120.795 0.331 . . . . 0.0 110.823 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -71.14 142.68 42.46 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.823 2.349 . . . . 0.0 111.861 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 14.2 p -166.65 139.02 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.259 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 20.3 m -65.78 -44.6 85.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.911 -176.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -123.65 122.94 39.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.85 174.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 12.6 t -74.03 139.73 44.93 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 70.63 123.65 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.019 -175.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 20.7 m -95.45 116.14 28.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.969 175.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -161.41 129.89 4.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.281 -178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 176.67 145.6 5.72 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.561 -0.616 . . . . 0.0 111.561 -178.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -62.64 -41.44 99.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.779 0.323 . . . . 0.0 110.678 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 4.6 t70 59.54 47.3 11.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.184 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 17.5 p -65.81 -40.84 92.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.193 -177.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 9.7 t -170.26 147.74 3.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.401 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -80.0 41.09 0.49 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.309 175.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.78 ' HB3' ' HB2' ' A' ' 447' ' ' LYS . 17.8 mm-40 59.37 67.36 0.91 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.856 -175.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -55.61 -35.11 65.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.933 172.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.9 m -77.62 -59.95 2.57 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.059 -178.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.78 ' HB2' ' HB3' ' A' ' 444' ' ' GLU . 81.1 tttt 33.07 75.67 0.05 OUTLIER 'General case' 0 C--O 1.235 0.294 0 N-CA-C 114.379 1.252 . . . . 0.0 114.379 176.034 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.702 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . 48.66 35.1 15.93 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 114.562 -1.199 . . . . 0.0 115.37 169.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.7 ' HG3' ' HB2' ' A' ' 454' ' ' CYS . 0.3 OUTLIER -85.81 149.45 25.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.921 0.86 . . . . 0.0 108.84 173.111 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -56.04 150.97 22.61 Favored Glycine 0 C--O 1.227 -0.318 0 C-N-CA 121.444 -0.408 . . . . 0.0 113.384 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.6 -33.48 66.27 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.79 -176.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 452' ' ' LYS . 27.3 mmtp -61.66 -37.93 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.87 0.367 . . . . 0.0 110.204 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -81.06 -48.04 12.74 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.781 175.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.7 ' HB2' ' HG3' ' A' ' 449' ' ' LYS . 0.5 OUTLIER -84.58 116.71 23.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.519 -173.715 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -89.43 139.81 30.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.837 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.538 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 10.5 t -58.78 -48.79 96.17 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.994 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.3 Cg_endo -58.51 -29.85 89.99 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.853 1.702 . . . . 0.0 112.007 178.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -84.05 -42.32 16.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 67.7 m -141.58 149.82 41.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.372 -173.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -79.37 135.69 36.78 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.998 0.428 . . . . 0.0 110.532 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 52.3 t-105 -106.28 132.35 52.44 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.855 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.422 ' OE2' ' HD2' ' A' ' 467' ' ' LYS . 30.2 mt-10 -129.64 79.94 1.93 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.856 0.36 . . . . 0.0 111.402 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.29 -63.11 2.96 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.363 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.1 36.49 0.53 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.833 -0.698 . . . . 0.0 111.786 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.0 t -157.87 141.94 15.91 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.702 ' H ' ' HA2' ' A' ' 448' ' ' GLY . 0.5 OUTLIER -104.7 145.93 29.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.879 -178.22 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.457 ' HA ' ' OE1' ' A' ' 444' ' ' GLU . 18.5 ptpt -163.52 159.46 22.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.987 0.422 . . . . 0.0 111.764 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.2 t0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.967 176.427 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.677 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.14 139.13 52.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.894 0.378 . . . . 0.0 111.526 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -161.06 130.93 4.92 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -68.31 -48.78 64.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.855 -174.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 8.3 t -156.69 -136.8 0.05 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -178.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp 57.42 37.48 27.91 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.109 0.481 . . . . 0.0 111.226 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 26.2 m -162.24 -46.75 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -163.5 -128.93 0.99 Allowed Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.47 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 4.6 p -156.41 120.73 2.37 Favored Pre-proline 0 C--N 1.317 -0.828 0 O-C-N 122.446 -0.443 . . . . 0.0 110.374 175.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 24.0 Cg_exo -64.58 99.99 0.32 Allowed 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.669 2.246 . . . . 0.0 111.239 -178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.64 111.14 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.826 -176.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.8 m 60.49 25.28 14.89 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.832 -175.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 65.11 -62.95 0.2 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.879 0.872 . . . . 0.0 111.875 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 13.1 m -80.99 122.66 27.55 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 177.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -74.19 138.61 43.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.787 0.327 . . . . 0.0 110.863 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 8.8 t -165.59 136.29 3.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.786 178.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 61.0 40.79 14.85 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.372 -176.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -171.86 42.15 0.18 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.641 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -84.14 -39.48 19.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.472 177.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -72.98 136.27 45.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.184 179.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 2.1 m -77.48 50.42 0.8 Allowed 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.965 -174.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.617 HG23 ' H ' ' A' ' 444' ' ' GLU . 7.4 t -97.72 -24.91 15.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.526 177.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 61.17 26.8 16.64 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.435 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.617 ' H ' HG23 ' A' ' 442' ' ' THR . 10.2 tt0 49.34 40.97 19.67 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.364 176.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -80.48 -24.43 39.48 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.769 -179.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.404 ' HB2' ' HA ' ' A' ' 467' ' ' LYS . 83.5 m -73.94 -35.46 64.57 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.372 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 444' ' ' GLU . 65.1 tttp -64.74 117.73 7.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 139.25 -35.97 1.91 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -175.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.78 137.75 54.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.131 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.76 -169.99 41.94 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 169.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -67.11 -34.89 78.58 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 117.108 0.454 . . . . 0.0 111.234 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.67 -38.92 53.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.118 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.44 -49.07 67.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.511 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 4.7 t -62.4 123.46 18.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.347 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 51.5 mttm -141.91 33.28 1.58 Allowed 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 122.023 0.916 . . . . 0.0 110.114 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.664 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 39.0 m 45.67 50.12 7.41 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 113.059 -1.882 . . . . 0.0 113.136 178.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' A' ' 456' ' ' SER . 5.2 Cg_exo -74.33 -44.75 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.902 1.735 . . . . 0.0 109.88 175.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.01 36.81 0.15 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 173.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 456' ' ' SER . 57.4 m -147.89 145.42 28.65 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.756 -171.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -114.41 136.47 52.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.747 0.308 . . . . 0.0 110.616 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 58.8 t-105 -80.94 118.63 22.59 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.791 ' HB3' ' HD2' ' A' ' 467' ' ' LYS . 34.2 tt0 -155.06 133.09 11.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.657 0.265 . . . . 0.0 110.724 -175.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.39 35.94 81.5 Favored Glycine 0 C--O 1.234 0.122 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.794 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 62.17 40.1 98.52 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.514 HG22 ' HG3' ' A' ' 467' ' ' LYS . 5.3 m -157.76 133.77 9.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.804 0.335 . . . . 0.0 110.529 -175.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 466' ' ' CYS . . . . . . . . . . . . . 11.9 t -86.62 119.41 26.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.791 ' HD2' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -157.85 155.12 29.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.752 -173.291 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.267 -0.873 . . . . 0.0 111.197 -176.493 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 7.0 m -65.42 -45.56 83.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.743 0.306 . . . . 0.0 110.374 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 39.2 tptt 69.82 -66.64 0.26 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.275 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.594 ' HA ' HG22 ' A' ' 434' ' ' THR . . . -95.94 118.94 33.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.638 0.256 . . . . 0.0 110.437 176.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 4.0 m -75.19 -40.68 59.16 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.397 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 426' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 426' ' ' LYS . 44.9 tptt 58.08 40.03 25.63 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.037 178.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.15 -36.63 40.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.592 178.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -173.9 -118.85 0.52 Allowed Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 110.701 -0.959 . . . . 0.0 110.701 -178.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 58.0 t -76.27 127.83 83.98 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -59.64 112.26 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.366 2.044 . . . . 0.0 112.126 -177.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.88 44.95 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.614 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 19.5 p 49.44 38.43 14.26 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.28 0.632 . . . . 0.0 111.891 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.56 -23.62 15.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.562 179.115 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 434' ' ' THR . . . . . 0.594 HG22 ' HA ' ' A' ' 424' ' ' ALA . 4.7 p -63.11 -57.7 9.71 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.685 -179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 51.18 49.22 21.54 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.41 175.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 13.2 t -82.2 143.45 31.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.671 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -155.3 -47.21 0.08 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.763 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 438' ' ' GLY . . . . . 0.741 ' HA3' ' HB2' ' A' ' 443' ' ' ALA . . . -89.51 -38.75 6.52 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.336 178.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 70.76 -53.08 0.67 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.723 0.809 . . . . 0.0 112.38 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -69.79 128.48 36.54 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.416 ' O ' ' HB ' ' A' ' 442' ' ' THR . 54.2 m 70.03 -65.92 0.29 Allowed 'General case' 0 C--N 1.331 -0.231 0 O-C-N 123.907 0.754 . . . . 0.0 111.273 -179.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.433 ' CG2' ' HB2' ' A' ' 445' ' ' LYS . 12.3 t 176.54 -32.95 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.876 174.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 443' ' ' ALA . . . . . 0.741 ' HB2' ' HA3' ' A' ' 438' ' ' GLY . . . 70.12 -56.84 0.58 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.723 0.809 . . . . 0.0 111.706 -179.271 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.57 ' HG3' ' HD2' ' A' ' 447' ' ' LYS . 9.5 mp0 -78.63 37.64 0.29 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.909 0.385 . . . . 0.0 111.455 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.453 ' HD2' ' SG ' ' A' ' 459' ' ' CYS . 24.2 ttmt -73.48 -33.14 64.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.53 0.681 . . . . 0.0 109.578 174.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 65.1 m -132.64 1.82 3.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.301 -173.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.57 ' HD2' ' HG3' ' A' ' 444' ' ' GLU . 37.1 ttmt -62.64 120.83 11.94 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.277 -177.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 115.31 -17.43 16.67 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.292 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.636 ' HB3' ' HB3' ' A' ' 453' ' ' ASP . 42.6 mtmt -81.74 142.3 32.77 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.857 0.328 . . . . 0.0 110.825 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.61 167.15 50.74 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -56.95 -38.55 73.09 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -69.54 -31.09 69.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.774 0.321 . . . . 0.0 111.263 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.636 ' HB3' ' HB3' ' A' ' 449' ' ' LYS . 2.3 t0 -81.57 -38.67 25.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.0 109.519 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -60.61 145.73 47.89 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.559 174.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.484 ' HD2' ' O ' ' A' ' 453' ' ' ASP . 7.8 mptt -137.29 148.78 46.63 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.287 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.508 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 3.5 m -63.41 -47.51 83.73 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 456' ' ' SER . 37.7 Cg_endo -65.25 -29.38 55.2 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 121.029 1.152 . . . . 0.0 110.965 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.54 -48.36 22.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.41 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.453 ' SG ' ' HD2' ' A' ' 445' ' ' LYS . 36.4 m -158.06 -162.17 1.11 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.175 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -121.65 136.92 54.93 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.313 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.461 ' CE3' ' HB2' ' A' ' 466' ' ' CYS . 71.9 t-105 -103.18 124.75 49.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.6 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -135.5 110.88 9.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.761 0.315 . . . . 0.0 110.781 -178.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 70.09 -67.02 0.68 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.668 -0.696 . . . . 0.0 113.034 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -169.44 43.08 0.21 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -157.78 138.22 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.938 0.399 . . . . 0.0 110.032 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.461 ' HB2' ' CE3' ' A' ' 461' ' ' TRP . 14.7 t -106.86 130.51 54.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.212 -176.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -161.49 150.68 16.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.168 0.508 . . . . 0.0 112.025 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 37.3 t0 . . . . . 0 C--O 1.245 0.859 0 CA-C-O 118.07 -0.967 . . . . 0.0 109.382 179.595 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.876 0 N-CA-C 112.203 -0.359 . . . . 0.0 112.203 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 15.4 t -179.96 143.8 0.18 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt 62.46 37.88 13.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.26 0.553 . . . . 0.0 110.242 -177.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -90.2 141.89 28.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.637 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.9 t -77.08 93.06 3.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -78.64 49.94 0.93 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.076 -177.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 22.8 t -94.23 126.18 39.32 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.499 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 158.29 -51.28 0.4 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.455 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 7.5 p -163.95 125.87 1.55 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-O 121.207 0.527 . . . . 0.0 111.031 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 16.5 Cg_exo -67.37 131.15 24.07 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.666 2.244 . . . . 0.0 110.846 178.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 4.4 t -84.51 46.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.411 0.624 . . . . 0.0 109.7 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 3.2 p -86.89 128.54 35.06 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.831 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -97.19 130.56 44.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.394 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.1 t -78.59 -39.7 36.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.69 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -171.75 143.39 1.67 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.685 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 1.9 p -70.15 81.78 0.52 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.338 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 60.67 -143.87 0.5 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.392 -175.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -167.32 130.36 2.1 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.209 179.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -172.42 127.59 0.54 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -82.57 54.17 2.56 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.905 0.383 . . . . 0.0 110.094 178.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.0 t -65.79 135.1 54.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.905 -177.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.422 ' H ' ' H ' ' A' ' 443' ' ' ALA . 8.9 t -156.34 -19.87 0.1 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.232 -176.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 443' ' ' ALA . . . . . 0.422 ' H ' ' H ' ' A' ' 442' ' ' THR . . . 60.83 -153.16 0.38 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.435 -178.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 444' ' ' GLU . 33.0 tt0 -91.84 39.5 1.01 Allowed 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.538 0.685 . . . . 0.0 110.654 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -71.02 -37.97 72.61 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 172.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.629 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 36.4 m -151.07 10.76 0.61 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.006 178.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -73.29 132.24 42.87 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.314 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 70.49 34.42 67.95 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.898 -0.592 . . . . 0.0 113.758 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -88.39 -49.6 6.84 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.332 -0.511 . . . . 0.0 110.731 176.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 105.21 150.84 20.14 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -171.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.01 -41.78 92.88 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.108 0.454 . . . . 0.0 112.104 -171.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -68.06 -38.89 82.96 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.706 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.75 -43.41 65.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.946 0.403 . . . . 0.0 110.415 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 34.2 t -54.76 120.27 6.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.171 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 12.0 tptt -89.28 123.03 33.11 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.483 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.0 m -58.92 -50.87 85.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -174.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 456' ' ' SER . 25.2 Cg_endo -61.37 -30.88 88.12 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 121.61 1.54 . . . . 0.0 111.811 178.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.73 -46.18 22.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.371 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 468' ' ' ASP . 66.3 m -148.15 143.23 26.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.102 0.477 . . . . 0.0 110.808 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -79.32 159.16 27.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.69 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.644 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 39.2 t-105 -102.09 124.12 47.14 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.247 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -106.71 59.61 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.359 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.49 -55.04 4.08 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.604 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.8 31.41 0.61 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.308 -0.717 . . . . 0.0 111.308 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 40.2 m -143.17 129.09 19.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.507 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.644 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 46.9 t -91.81 117.08 29.44 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.08 134.61 1.6 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.569 ' HB2' ' HA ' ' A' ' 459' ' ' CYS . 32.0 t70 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.362 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 422' ' ' THR . . . . . 0.463 ' HB ' ' H ' ' A' ' 423' ' ' LYS . 1.0 OUTLIER -87.32 -145.6 0.13 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.636 0.255 . . . . 0.0 111.37 179.184 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 423' ' ' LYS . . . . . 0.463 ' H ' ' HB ' ' A' ' 422' ' ' THR . 21.9 pttp -69.84 -33.92 72.94 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.732 0.301 . . . . 0.0 111.132 -178.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.447 ' HB2' HG12 ' A' ' 429' ' ' VAL . . . -148.34 127.18 12.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.08 -178.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 20.1 m -93.41 41.96 1.09 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.312 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 20.7 tptm 67.45 118.13 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.767 0.827 . . . . 0.0 111.643 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 14.4 p 49.83 47.17 23.43 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.795 -179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 172.77 132.46 1.52 Allowed Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 111.314 -0.714 . . . . 0.0 111.314 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.651 ' HB ' HG13 ' A' ' 431' ' ' VAL . 13.4 m -131.72 125.55 20.49 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-O 121.147 0.499 . . . . 0.0 111.971 -177.221 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -88.73 45.07 0.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.374 2.716 . . . . 0.0 111.23 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.651 HG13 ' HB ' ' A' ' 429' ' ' VAL . 31.3 m -83.3 -7.56 10.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.13 -173.041 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 432' ' ' THR . . . . . 0.492 HG22 ' HG3' ' A' ' 433' ' ' GLN . 33.1 m 70.06 -68.08 0.21 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.145 178.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.492 ' HG3' HG22 ' A' ' 432' ' ' THR . 87.1 mt-30 -143.89 -48.56 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.328 0.109 . . . . 0.0 111.023 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 434' ' ' THR . . . . . 0.656 HG22 ' HB2' ' A' ' 437' ' ' ALA . 23.7 m 62.21 55.21 2.46 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.701 0.762 . . . . 0.0 110.795 -177.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -84.89 144.06 28.62 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.507 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 436' ' ' THR . . . . . 0.592 ' HB ' ' HA ' ' A' ' 440' ' ' ASP . 3.3 p 49.93 54.26 11.38 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.552 0.691 . . . . 0.0 111.09 -173.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 437' ' ' ALA . . . . . 0.656 ' HB2' HG22 ' A' ' 434' ' ' THR . . . -63.71 -47.89 79.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.57 -173.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -62.4 -41.06 99.78 Favored Glycine 0 C--O 1.235 0.189 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.083 -178.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -164.91 126.05 2.05 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 177.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 440' ' ' ASP . . . . . 0.592 ' HA ' ' HB ' ' A' ' 436' ' ' THR . 19.3 m-20 -72.4 125.63 27.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.014 -179.201 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 3.8 p -72.62 -40.11 66.73 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.064 0.459 . . . . 0.0 110.075 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.52 ' HB ' ' CD ' ' A' ' 445' ' ' LYS . 54.7 m -80.38 124.63 29.04 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.769 175.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -78.88 -49.48 12.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.276 0.56 . . . . 0.0 110.048 176.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -83.27 72.54 10.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.871 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.765 ' HE2' ' HB3' ' A' ' 468' ' ' ASP . 14.3 mmmm -73.86 53.94 0.48 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.158 177.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.46 ' SG ' ' HD3' ' A' ' 449' ' ' LYS . 11.8 t 74.29 16.21 3.43 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 122.09 0.948 . . . . 0.0 109.36 -173.254 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 89.2 tttt -70.6 126.23 29.04 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.146 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 131.97 -30.56 3.19 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.193 -178.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.46 ' HD3' ' SG ' ' A' ' 446' ' ' CYS . 30.9 mtpp -76.07 137.47 40.2 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.257 0.551 . . . . 0.0 111.123 -177.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -78.48 162.25 49.14 Favored Glycine 0 C--O 1.22 -0.728 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.372 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.86 -35.32 76.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.718 0.759 . . . . 0.0 110.648 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -84.16 40.52 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.305 0.574 . . . . 0.0 110.316 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -164.09 -50.39 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.867 -177.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.86 132.83 40.59 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 21.5 tptm -144.61 45.95 1.38 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.789 0.804 . . . . 0.0 110.779 -171.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.668 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 20.3 m 44.25 44.47 1.55 Allowed Pre-proline 0 C--N 1.314 -0.95 0 CA-C-N 114.084 -1.416 . . . . 0.0 114.266 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.596 ' HD3' ' N ' ' A' ' 456' ' ' SER . 4.5 Cg_endo -82.05 -48.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.921 1.747 . . . . 0.0 110.326 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.425 ' H ' ' HD2' ' A' ' 457' ' ' PRO . 8.5 t70 -148.25 37.9 0.86 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 173.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.668 ' O ' ' HA ' ' A' ' 456' ' ' SER . 4.0 m -148.64 132.66 17.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.85 -172.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.33 136.58 45.81 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.189 177.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.458 ' HE3' ' SG ' ' A' ' 466' ' ' CYS . 32.2 t-105 -85.93 126.45 34.11 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.031 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.59 121.33 9.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.761 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 55.53 45.75 83.34 Favored Glycine 0 N--CA 1.453 -0.191 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.999 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.78 35.94 92.0 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.589 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 60.9 m -155.17 134.22 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.552 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -85.52 130.63 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.018 178.686 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 445' ' ' LYS . 20.7 pttp -168.28 133.8 1.82 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.765 ' HB3' ' HE2' ' A' ' 445' ' ' LYS . 60.4 t0 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.964 -0.541 . . . . 0.0 109.773 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 111.79 -0.524 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 28.5 m -67.12 115.37 6.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.785 0.326 . . . . 0.0 111.143 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -78.86 -47.08 17.26 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 58.43 -155.18 0.35 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.657 178.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 13.3 m 64.03 176.84 0.17 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.162 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 426' ' ' LYS . . . . . 0.532 ' NZ ' ' HB3' ' A' ' 426' ' ' LYS . 8.1 mtpm? -82.88 46.1 1.06 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.129 0.49 . . . . 0.0 110.094 176.479 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 11.2 m -69.67 131.88 45.3 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.37 -176.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -83.98 -147.64 8.15 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.749 -0.739 . . . . 0.0 111.662 176.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 10.4 t -94.76 117.45 66.91 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.767 ' HG2' ' HE3' ' A' ' 449' ' ' LYS . 57.1 Cg_endo -76.18 59.22 5.9 Favored 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.859 2.373 . . . . 0.0 113.278 -175.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 3.2 t -81.19 49.9 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 33.6 m 66.86 -75.05 0.06 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.768 -173.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 52.28 -155.59 0.17 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.371 0.668 . . . . 0.0 112.593 172.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 2.7 m -66.48 -42.67 87.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.038 -176.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -57.79 -29.36 64.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.128 -179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 3.5 m 64.35 51.36 2.09 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -176.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -68.68 69.8 0.17 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.181 -174.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 438' ' ' GLY . . . . . 0.602 ' HA3' ' HA ' ' A' ' 445' ' ' LYS . . . 177.72 36.89 0.06 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 178.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -92.99 34.76 1.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.944 0.402 . . . . 0.0 111.076 -179.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -74.63 156.12 37.08 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 13.1 t -61.95 -24.06 66.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.258 0.551 . . . . 0.0 110.316 178.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.829 HG22 ' HG2' ' A' ' 444' ' ' GLU . 25.7 m -71.39 -11.54 60.94 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.059 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 74.91 -32.87 0.23 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.856 0.862 . . . . 0.0 112.317 179.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.829 ' HG2' HG22 ' A' ' 442' ' ' THR . 13.5 mm-40 -59.4 116.87 4.24 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.924 0.392 . . . . 0.0 110.339 -174.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.602 ' HA ' ' HA3' ' A' ' 438' ' ' GLY . 52.0 mtmt -71.29 -31.17 67.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.654 -179.03 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.685 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 34.3 m -72.26 -32.71 66.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.247 -178.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 83.1 tttt -56.51 133.33 53.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.628 -177.245 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 102.18 -28.59 15.25 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.746 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.767 ' HE3' ' HG2' ' A' ' 430' ' ' PRO . 62.6 mtpt -65.1 144.15 57.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.004 0.43 . . . . 0.0 111.71 -177.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 162.61 54.72 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.457 178.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -59.78 -42.92 94.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.299 0.549 . . . . 0.0 111.051 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -65.83 -36.39 83.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.782 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -75.15 -45.62 39.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.743 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 51.0 t -56.68 119.07 5.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.282 -178.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -81.04 109.44 15.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.526 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.6 m -59.97 -48.66 94.16 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -171.439 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.0 Cg_endo -58.28 -38.74 89.53 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 121.175 1.25 . . . . 0.0 111.356 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -77.16 -47.99 18.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.4 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.62 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 16.5 m -127.06 132.6 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -79.99 130.82 35.57 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.941 0.401 . . . . 0.0 110.913 -176.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -82.3 122.46 27.98 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -166.44 137.65 3.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.718 0.294 . . . . 0.0 110.485 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 69.77 37.03 75.61 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.453 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 58.12 34.6 73.74 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.393 -0.432 . . . . 0.0 112.773 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 6.1 t -167.68 157.6 10.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.014 0.435 . . . . 0.0 110.119 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.685 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 14.4 t -82.36 120.8 25.89 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.469 -176.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 459' ' ' CYS . 74.1 mmtt -90.73 146.51 23.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.751 0.31 . . . . 0.0 111.066 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 444' ' ' GLU . 40.3 t0 . . . . . 0 C--O 1.246 0.92 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.033 0 N-CA-C 112.121 -0.392 . . . . 0.0 112.121 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 22.0 m -66.0 128.23 35.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.533 0.206 . . . . 0.0 110.52 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 423' ' ' LYS . . . . . 0.816 ' HA ' ' HE2' ' A' ' 423' ' ' LYS . 0.5 OUTLIER -69.09 -40.83 78.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.624 0.249 . . . . 0.0 110.776 -178.511 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 63.76 -148.29 0.31 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.282 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.1 m 56.35 40.64 29.71 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 121.372 0.606 . . . . 0.0 110.168 -176.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -76.11 133.38 40.29 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.356 -177.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 15.3 m 58.89 35.41 24.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.967 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 174.75 44.5 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.874 -178.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.486 HG13 ' HA ' ' A' ' 432' ' ' THR . 8.5 p -69.4 131.79 89.96 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 176.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.12 -52.42 7.93 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.719 2.279 . . . . 0.0 112.057 -176.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 20.5 t -84.31 63.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.221 0.534 . . . . 0.0 109.77 174.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 432' ' ' THR . . . . . 0.486 ' HA ' HG13 ' A' ' 429' ' ' VAL . 9.9 t -70.86 -34.08 71.27 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.853 -175.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.472 ' HG3' HG23 ' A' ' 432' ' ' THR . 25.2 mt-30 -101.6 150.87 22.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.952 178.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 18.4 p -79.95 142.77 34.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.571 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -62.12 -37.66 86.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.017 0.437 . . . . 0.0 110.498 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 25.4 m -86.78 139.05 31.09 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.908 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 65.59 41.4 4.1 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.528 0.517 . . . . 0.0 110.663 -176.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 438' ' ' GLY . . . . . 0.41 ' C ' ' H ' ' A' ' 440' ' ' ASP . . . -83.53 -45.66 6.38 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.823 178.196 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 439' ' ' ALA . . . . . 0.723 ' HA ' ' HB2' ' A' ' 443' ' ' ALA . . . 70.87 -32.86 0.25 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.573 0.749 . . . . 0.0 112.665 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 440' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 438' ' ' GLY . 51.7 m-20 -58.41 137.67 57.12 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 122.235 0.214 . . . . 0.0 111.032 -178.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 1.7 m 61.25 38.42 16.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.104 -178.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 28.0 m 69.03 128.2 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.388 -178.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 443' ' ' ALA . . . . . 0.723 ' HB2' ' HA ' ' A' ' 439' ' ' ALA . . . -82.32 47.22 1.12 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.31 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 55.73 55.56 7.01 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.632 177.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -74.83 -44.04 51.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.477 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 73.0 m -80.23 -44.44 19.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.567 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.2 tptt -60.33 113.66 2.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.727 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 127.01 -25.56 5.22 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.602 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.516 ' HE3' ' OD2' ' A' ' 453' ' ' ASP . 55.3 mtpt -75.45 141.28 43.17 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 120.933 0.397 . . . . 0.0 111.032 -177.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.31 158.2 50.45 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.961 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 451' ' ' GLU . . . . . 0.538 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 38.9 tt0 -60.25 -36.9 78.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.962 0.381 . . . . 0.0 111.346 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -83.8 37.83 0.61 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.223 0.535 . . . . 0.0 110.844 178.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.516 ' OD2' ' HE3' ' A' ' 449' ' ' LYS . 29.4 t70 -163.52 -50.13 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.909 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 1.7 t -68.12 125.67 27.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.461 176.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 41.6 mmtm -92.26 135.64 33.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -178.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.502 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 23.1 t -60.56 -50.0 87.47 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.502 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 26.7 Cg_exo -62.42 -29.12 78.79 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.632 1.554 . . . . 0.0 111.504 178.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.458 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 38.0 t70 -80.8 -42.32 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.241 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.84 134.47 24.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -66.23 115.87 6.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.941 0.401 . . . . 0.0 111.23 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.538 ' CZ2' ' HB2' ' A' ' 451' ' ' GLU . 48.9 t-105 -85.44 119.38 25.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 172.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -154.58 126.03 7.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.695 0.283 . . . . 0.0 110.734 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.58 33.08 75.74 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.082 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.43 39.21 97.48 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 121.188 -0.53 . . . . 0.0 112.37 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.8 t -165.9 145.16 6.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.1 OUTLIER -86.21 135.51 33.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 -175.571 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -130.88 139.72 50.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.009 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 33.4 t70 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.785 -0.626 . . . . 0.0 109.991 178.778 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.08 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.8 t 44.23 -128.88 0.93 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.746 0.818 . . . . 0.0 111.122 -176.783 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -63.56 132.36 50.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 118.076 0.398 . . . . 0.0 110.393 179.104 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 73.41 137.43 0.05 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 124.055 0.847 . . . . 0.0 111.002 -174.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.4 t -64.7 -44.15 91.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.768 -176.237 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.6 136.89 19.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 0.0 110.239 177.123 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 11.6 p -158.62 40.73 0.24 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.716 -176.093 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -71.75 135.8 23.68 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.753 177.61 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 5.4 p -137.07 131.4 17.81 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -178.733 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.62 -55.13 2.26 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.596 2.198 . . . . 0.0 112.974 -174.444 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 12.2 t 57.55 42.82 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-O 121.927 0.87 . . . . 0.0 109.68 -177.143 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.9 p -92.59 44.54 1.16 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.562 -176.469 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -87.0 130.13 34.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.352 177.943 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 5.8 t -164.76 123.53 1.78 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.11 0.481 . . . . 0.0 110.854 -179.676 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -149.72 133.87 17.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.476 179.282 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.9 m -70.99 120.34 16.42 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.12 -52.06 57.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.557 -174.201 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -170.09 59.08 0.19 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.319 -179.356 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -162.53 36.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.097 0.475 . . . . 0.0 110.883 -178.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -82.04 113.81 20.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.312 177.695 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 89.0 m 69.42 -57.07 0.54 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.515 -175.047 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 9.3 t -175.29 153.98 1.64 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -178.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -61.6 117.79 6.22 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 177.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.942 ' HG3' ' HB3' ' A' ' 447' ' ' LYS . 30.8 tt0 -74.06 115.0 13.03 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.153 0.501 . . . . 0.0 111.317 -176.99 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.511 ' HB3' ' OD2' ' A' ' 468' ' ' ASP . 6.2 ttpm? -137.32 -44.56 0.55 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.107 -0.952 . . . . 0.0 108.516 176.725 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.558 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 46.0 m -87.4 -30.81 20.45 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.66 -1.155 . . . . 0.0 110.753 175.762 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.942 ' HB3' ' HG3' ' A' ' 444' ' ' GLU . 62.8 tttm -62.46 133.5 55.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.372 -175.414 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.93 53.87 6.08 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.288 176.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.822 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 49.9 mtpt -122.17 -50.71 2.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.994 0.426 . . . . 0.0 111.44 178.238 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 126.53 156.01 9.08 Favored Glycine 0 N--CA 1.444 -0.803 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -172.003 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -61.84 -41.97 98.46 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.323 0.562 . . . . 0.0 111.392 -173.369 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.6 pttm -71.95 -34.78 69.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.624 179.11 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.822 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -75.51 -40.19 57.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.388 -179.033 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.8 t -59.9 118.62 6.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.176 179.025 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -74.72 123.25 24.58 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.235 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.457 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 46.0 m -71.13 -51.57 10.28 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -173.349 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 456' ' ' SER . 28.6 Cg_endo -63.61 -27.33 69.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.512 1.475 . . . . 0.0 111.871 -179.708 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -97.39 -33.17 11.51 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.479 -174.278 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.2 m -129.98 150.27 51.34 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 122.127 -0.358 . . . . 0.0 110.974 -172.848 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.479 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 63.5 mttm -86.87 139.11 30.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.33 -179.119 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.476 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.2 t-105 -111.78 122.74 48.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.523 ' HB3' ' HE3' ' A' ' 467' ' ' LYS . 69.4 tt0 -158.58 134.54 9.04 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.513 0.196 . . . . 0.0 110.866 -175.885 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.35 31.63 81.05 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.354 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.53 37.83 94.94 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.171 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.8 t -165.35 146.91 7.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.097 0.475 . . . . 0.0 110.711 179.398 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.7 t -87.11 147.49 25.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.094 -175.22 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.523 ' HE3' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.71 142.72 27.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.973 0.416 . . . . 0.0 110.456 178.565 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.511 ' OD2' ' HB3' ' A' ' 445' ' ' LYS . 2.6 m-20 . . . . . 0 C--O 1.254 1.317 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.356 -179.128 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.836 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 15.0 m -71.95 120.0 16.93 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.968 0.413 . . . . 0.0 111.022 -178.383 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -82.24 -42.02 19.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.505 177.023 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 68.36 -78.16 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 O-C-N 124.239 0.962 . . . . 0.0 110.871 -177.44 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.6 t -88.62 143.13 27.15 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 176.038 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -156.02 157.36 36.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.713 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.6 m 73.42 -47.32 0.66 Allowed 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.792 0.683 . . . . 0.0 111.571 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 179.5 162.03 27.91 Favored Glycine 0 N--CA 1.442 -0.94 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.715 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 431' ' ' VAL . 58.5 t -58.87 132.59 86.69 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.64 0.22 . . . . 0.0 110.535 179.165 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -70.8 38.59 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.983 2.455 . . . . 0.0 113.057 -177.119 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.405 ' H ' ' C ' ' A' ' 429' ' ' VAL . 7.7 p -83.74 63.22 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.951 0.882 . . . . 0.0 110.027 175.497 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 2.5 m -74.63 56.27 0.69 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.134 -176.449 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -158.36 48.33 0.36 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -177.374 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 66.6 p 53.64 -154.56 0.24 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.963 -175.534 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -148.8 143.57 26.43 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 -177.885 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 9.1 m -100.6 -54.04 2.94 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.463 -179.454 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 176.68 -54.48 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.139 176.681 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -162.1 30.71 0.3 Allowed Glycine 0 N--CA 1.451 -0.305 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 179.025 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -164.25 43.46 0.1 Allowed 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 178.866 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.83 -37.78 88.65 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.149 -173.615 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.1 p -76.51 39.23 0.2 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.376 -179.899 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 21.4 m -65.18 -62.56 1.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.06 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 443' ' ' ALA . . . . . 0.498 ' HB3' ' OD2' ' A' ' 468' ' ' ASP . . . 170.22 -42.28 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.304 175.292 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.663 ' HG2' ' HB3' ' A' ' 447' ' ' LYS . 22.3 mt-10 61.52 40.93 13.14 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.813 -175.47 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.567 ' HB3' ' OD1' ' A' ' 468' ' ' ASP . 6.3 ttpm? -66.17 -45.72 79.9 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.933 172.628 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 10.7 t -98.34 -41.03 8.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.554 177.262 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.663 ' HB3' ' HG2' ' A' ' 444' ' ' GLU . 26.5 ttpp -58.62 125.2 22.44 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.349 -175.048 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.1 -20.52 4.49 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.255 -176.57 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.874 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 29.7 mtpt -93.45 -152.74 0.34 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.224 -178.113 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -127.83 160.94 21.82 Favored Glycine 0 C--O 1.219 -0.794 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.654 177.93 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -42.6 -43.08 3.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -174.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -64.0 -42.9 97.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.232 -178.66 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.755 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 46.6 m-20 -73.11 -51.08 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.658 0.742 . . . . 0.0 109.6 175.247 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.874 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 77.5 m -72.6 53.83 0.32 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 124.907 1.283 . . . . 0.0 111.472 177.391 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.656 ' HE2' ' HG2' ' A' ' 457' ' ' PRO . 20.6 ptmt -63.12 141.95 58.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.556 -177.357 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.519 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 7.3 t -50.4 -48.54 80.85 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.568 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.656 ' HG2' ' HE2' ' A' ' 455' ' ' LYS . 13.5 Cg_endo -57.63 -37.38 97.09 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 121.769 1.646 . . . . 0.0 112.621 -179.367 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -85.42 -36.82 20.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.136 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 456' ' ' SER . 82.0 m -138.54 135.54 35.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.006 -173.026 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.71 ' HB3' ' HB2' ' A' ' 467' ' ' LYS . 83.1 tttt -72.19 143.79 48.76 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 175.076 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.677 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 44.2 t-105 -116.49 126.68 53.7 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.08 -176.535 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.693 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 41.9 tt0 -95.99 -65.64 0.96 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 0.0 110.896 -179.11 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -179.24 87.34 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 68.56 31.65 73.94 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.744 -175.861 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.4 t -166.2 130.17 2.13 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -179.599 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.677 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 1.7 m -77.99 140.73 39.21 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.098 -177.233 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.71 ' HB2' ' HB3' ' A' ' 460' ' ' LYS . 27.1 mmmt -93.72 171.32 8.96 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.465 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.567 ' OD1' ' HB3' ' A' ' 445' ' ' LYS . 31.4 t70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.802 -169.6 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.741 0 N-CA-C 111.957 -0.457 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 422' ' ' THR . . . . . 0.456 ' HB ' ' HD3' ' A' ' 426' ' ' LYS . 4.7 m -62.08 -48.94 77.95 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.685 0.243 . . . . 0.0 110.931 -178.618 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp 55.97 -135.42 1.29 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.77 179.73 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 55.58 41.94 30.14 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 122.583 0.353 . . . . 0.0 111.417 178.756 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 37.4 m 61.04 71.53 0.56 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.341 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 426' ' ' LYS . . . . . 0.456 ' HD3' ' HB ' ' A' ' 422' ' ' THR . 14.0 mmmm -52.49 127.31 22.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.81 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 6.1 p -172.85 -41.41 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.934 -178.875 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 77.74 -59.33 3.8 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.4 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.446 HG22 HG12 ' A' ' 431' ' ' VAL . 8.0 p 34.72 65.02 1.69 Allowed Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 123.962 0.905 . . . . 0.0 112.094 178.894 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -76.78 43.8 1.32 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.608 2.205 . . . . 0.0 112.742 -177.026 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.446 HG12 HG22 ' A' ' 429' ' ' VAL . 7.3 p -71.83 121.82 22.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 176.884 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 432' ' ' THR . . . . . 0.63 HG22 ' HB3' ' A' ' 435' ' ' GLN . 2.2 m -157.9 49.56 0.41 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.233 0.539 . . . . 0.0 109.956 -173.761 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -74.86 -40.87 60.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.794 -179.509 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 3.7 p -84.35 43.62 0.97 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.885 176.227 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 435' ' ' GLN . . . . . 0.63 ' HB3' HG22 ' A' ' 432' ' ' THR . 20.2 pt20 -70.18 137.8 51.28 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.065 -177.312 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 14.5 t -175.17 147.19 0.89 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.629 179.573 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -77.56 -155.5 0.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.823 0.344 . . . . 0.0 110.825 -178.545 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 179.3 -129.9 1.44 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 111.572 -0.611 . . . . 0.0 111.572 179.47 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 59.25 55.66 4.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.977 0.418 . . . . 0.0 110.662 179.544 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -155.32 116.61 3.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.781 -178.652 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 1.8 p -106.72 -26.94 11.09 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.032 -177.493 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.614 HG23 ' HB2' ' A' ' 468' ' ' ASP . 34.8 m -63.03 -53.16 58.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.338 -178.792 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 66.94 -11.41 0.26 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.179 0.591 . . . . 0.0 112.366 -179.43 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.565 ' H ' HG22 ' A' ' 442' ' ' THR . 86.3 mt-10 58.61 44.83 16.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.232 0.539 . . . . 0.0 110.868 -177.55 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.421 ' HE3' ' SG ' ' A' ' 446' ' ' CYS . 2.5 tmmm? -69.52 -39.34 77.6 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 174.226 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.841 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 21.4 m -117.38 -27.98 6.24 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.754 179.119 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.641 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 64.2 tttp -54.57 110.57 0.65 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.754 -176.189 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 112.55 -19.35 21.85 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.747 -0.74 . . . . 0.0 113.096 -178.533 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.834 ' HE3' ' HB3' ' A' ' 453' ' ' ASP . 31.1 mmmt -68.86 142.8 54.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 117.01 0.405 . . . . 0.0 111.335 -178.152 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -68.2 163.32 48.5 Favored Glycine 0 C--O 1.224 -0.502 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 175.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -55.01 -45.09 75.06 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -175.458 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -65.37 -44.84 86.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.898 0.38 . . . . 0.0 110.595 -179.008 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.834 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -67.13 -44.75 79.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.157 179.226 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 33.4 t -64.88 122.12 16.22 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.49 -175.441 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 68.4 mttm -76.27 122.53 24.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.701 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.503 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 19.4 m -68.39 -50.31 28.4 Favored Pre-proline 0 C--N 1.322 -0.589 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -174.55 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 21.3 Cg_exo -65.01 -37.58 32.61 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 121.247 1.298 . . . . 0.0 110.974 179.076 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 7.7 t70 -71.28 -39.54 71.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.368 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 54.6 m -138.65 140.34 38.83 Favored 'General case' 0 N--CA 1.458 -0.053 0 CA-C-O 121.24 0.543 . . . . 0.0 112.091 -174.051 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 467' ' ' LYS . 62.0 tttp -71.17 135.62 47.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.739 -178.17 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.625 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.4 t-105 -100.77 107.89 19.57 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 174.354 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.493 ' HB2' ' CD ' ' A' ' 467' ' ' LYS . 22.8 tt0 -82.7 50.8 1.75 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.019 0.437 . . . . 0.0 110.875 -177.812 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 54.61 31.68 53.0 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.699 -0.682 . . . . 0.0 113.755 177.931 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 161.45 -40.57 0.4 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.8 179.064 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.7 t -115.37 134.56 54.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.247 0.546 . . . . 0.0 110.812 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.841 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 47.4 t -81.95 140.24 34.13 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.633 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.493 ' CD ' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.34 147.21 30.1 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.417 0.627 . . . . 0.0 111.192 -174.352 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.614 ' HB2' HG23 ' A' ' 442' ' ' THR . 19.9 m-20 . . . . . 0 C--N 1.316 -0.88 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.94 -179.473 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.746 0 N-CA-C 112.17 -0.372 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 6.7 t -75.78 140.87 42.59 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 120.885 0.374 . . . . 0.0 110.038 178.464 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -86.83 72.91 10.07 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.709 -178.084 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 72.14 -53.68 0.69 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.582 -177.168 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 69.6 m -155.27 110.95 3.09 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.588 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 99.8 mttt 55.27 -145.96 0.6 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.127 -176.769 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 3.4 p -83.66 61.03 6.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.875 0.369 . . . . 0.0 111.388 179.252 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -64.25 125.14 31.31 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.069 -179.827 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 20.4 t 55.45 69.7 1.86 Allowed Pre-proline 0 C--O 1.235 0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 110.484 -177.355 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.08 121.88 9.11 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.39 2.06 . . . . 0.0 112.019 -177.611 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 435' ' ' GLN . 7.4 p -70.19 128.61 33.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.158 178.002 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 19.0 p -138.05 47.6 2.01 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.438 -176.099 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 73.07 139.33 0.06 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.404 -176.229 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 67.9 p 50.17 49.11 21.07 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.688 -175.406 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 435' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 431' ' ' VAL . 45.1 tp60 70.44 -81.25 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.807 -172.139 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 15.3 t 179.11 133.19 0.09 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.04 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 57.46 -136.4 1.03 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.586 -175.514 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -169.04 133.44 2.86 Favored Glycine 0 N--CA 1.443 -0.857 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 179.198 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 56.99 59.23 3.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.866 0.365 . . . . 0.0 110.614 -178.641 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 440' ' ' ASP . . . . . 0.573 ' O ' ' HB ' ' A' ' 441' ' ' THR . 12.7 p-10 -58.62 117.22 4.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.551 -177.987 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.772 HG23 HG22 ' A' ' 442' ' ' THR . 14.9 t 165.42 -28.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.953 -177.776 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.772 HG22 HG23 ' A' ' 441' ' ' THR . 3.2 t -161.37 136.43 7.48 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.451 177.177 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -64.21 -57.01 10.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.911 -173.537 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.515 ' HG2' ' H ' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -117.15 16.26 14.95 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.471 0.653 . . . . 0.0 111.356 -175.871 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.463 ' HA ' ' CG2' ' A' ' 442' ' ' THR . 24.1 mtmm 62.8 31.63 16.37 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.654 -1.157 . . . . 0.0 109.665 -177.377 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.621 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 75.0 m 69.69 13.29 8.16 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 113.93 -1.486 . . . . 0.0 111.849 176.805 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.515 ' H ' ' HG2' ' A' ' 444' ' ' GLU . 40.8 ttmt -57.67 117.92 4.72 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.011 -176.815 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 56.35 46.32 87.11 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.308 -0.86 . . . . 0.0 113.822 173.842 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.594 ' HD2' ' HA ' ' A' ' 454' ' ' CYS . 12.4 ptpt -90.89 -41.37 11.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 117.203 0.501 . . . . 0.0 111.849 -179.65 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 123.91 151.68 8.24 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.999 -178.857 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 451' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 453' ' ' ASP . 6.4 tm-20 -66.28 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.563 0.181 . . . . 0.0 111.033 -176.049 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -79.15 38.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.175 0.512 . . . . 0.0 110.52 177.676 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 451' ' ' GLU . 50.6 t0 -166.22 -43.85 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.496 -178.93 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.594 ' HA ' ' HD2' ' A' ' 449' ' ' LYS . 53.7 t -64.16 112.15 2.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.242 -176.072 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.435 ' O ' ' HD3' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -170.65 138.24 1.42 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.432 168.911 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 458' ' ' ASP . 12.2 t 170.04 142.15 0.08 OUTLIER Pre-proline 0 C--N 1.315 -0.928 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.2 -176.254 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.77 8.27 1.04 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 121.603 1.535 . . . . 0.0 110.008 172.753 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.495 ' H ' ' C ' ' A' ' 456' ' ' SER . 87.8 m-20 -115.17 -52.17 2.69 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.992 177.972 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 63.8 m -82.44 131.59 35.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.691 179.74 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.48 141.71 44.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.256 -178.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -85.87 123.51 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.699 176.218 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -103.87 55.83 0.73 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.855 0.36 . . . . 0.0 110.711 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.62 -52.16 3.11 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.199 -0.524 . . . . 0.0 113.359 179.166 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -152.2 33.88 0.85 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.09 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.5 t -171.4 134.08 0.86 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.621 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.8 t -91.98 140.66 29.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.286 -0.416 . . . . 0.0 109.911 -176.848 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -168.21 136.56 2.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.159 0.504 . . . . 0.0 111.414 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 56.8 t0 . . . . . 0 C--O 1.248 1.014 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.323 175.674 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.757 0 N-CA-C 111.941 -0.463 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 11.7 t -84.57 -36.11 22.32 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.884 0.373 . . . . 0.0 110.758 -179.311 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 423' ' ' LYS . . . . . 0.438 ' HA ' ' HG3' ' A' ' 426' ' ' LYS . 14.3 ttpp -84.97 53.55 2.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.156 0.503 . . . . 0.0 110.941 179.996 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -100.9 123.14 44.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.686 179.116 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 18.3 t 58.68 39.07 24.86 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.569 0.543 . . . . 0.0 110.937 179.521 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 426' ' ' LYS . . . . . 0.438 ' HG3' ' HA ' ' A' ' 423' ' ' LYS . 30.3 mmmt -88.0 -31.74 19.19 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 178.516 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 32.6 t 71.72 145.42 0.07 Allowed 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.661 0.601 . . . . 0.0 110.662 -178.825 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -65.62 -58.93 8.31 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.691 -175.367 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 85.0 t -144.23 121.21 6.49 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-O 120.546 0.212 . . . . 0.0 110.521 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.53 128.32 16.06 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.379 2.053 . . . . 0.0 110.957 175.882 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 20.8 m -61.5 127.9 22.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.487 0.661 . . . . 0.0 111.85 -174.808 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.3 p -87.27 -45.13 10.89 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.404 178.178 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -135.43 -142.3 0.18 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.825 178.735 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 24.9 m -80.33 131.57 35.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.757 0.313 . . . . 0.0 110.462 178.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -68.27 159.64 30.87 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.7 -177.74 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.1 p -55.67 135.98 50.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.995 -178.62 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.66 -47.6 38.6 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.397 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -178.8 -53.84 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.293 179.052 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -130.04 122.24 28.0 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 176.293 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -72.03 128.35 35.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.364 -175.144 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 5.6 t -168.2 120.21 0.84 Allowed 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.402 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 48.6 m 69.13 -65.96 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.887 -179.786 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -178.35 -45.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 176.869 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 445' ' ' LYS . 40.3 tt0 -155.54 45.22 0.47 Allowed 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 114.782 -1.099 . . . . 0.0 108.126 176.407 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.718 ' O ' ' HB2' ' A' ' 446' ' ' CYS . 60.7 mttp 73.63 -53.8 0.69 Allowed 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 114.165 -1.38 . . . . 0.0 110.425 -172.961 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.718 ' HB2' ' O ' ' A' ' 445' ' ' LYS . 6.4 t 157.37 7.51 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 O-C-N 124.695 1.247 . . . . 0.0 109.341 175.763 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.411 ' H ' ' H ' ' A' ' 446' ' ' CYS . 24.3 ttpp -63.37 132.12 50.48 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.436 -175.111 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 138.56 -39.26 1.59 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.87 143.64 56.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.388 -0.406 . . . . 0.0 110.751 179.027 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.73 166.0 49.74 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 175.2 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 451' ' ' GLU . . . . . 0.6 ' HG2' ' H ' ' A' ' 452' ' ' LYS . 12.3 pm0 -55.07 -56.76 16.22 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.6 ' H ' ' HG2' ' A' ' 451' ' ' GLU . 1.3 mptm? -71.23 -37.11 72.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.853 0.358 . . . . 0.0 110.638 177.949 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -63.6 -34.06 76.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.86 -178.152 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.0 115.64 3.0 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.248 176.166 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -84.48 128.23 34.47 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -177.87 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.611 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 1.9 m -60.27 -54.53 54.24 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -171.909 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 46.6 Cg_exo -57.77 -33.31 96.68 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.733 1.622 . . . . 0.0 111.538 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -77.08 -49.16 15.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.439 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 25.2 m -151.69 136.36 17.07 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.411 -174.949 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -86.16 141.05 29.64 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.102 -0.374 . . . . 0.0 110.175 176.531 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -87.43 118.23 26.75 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.265 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.517 ' HB2' ' HE3' ' A' ' 467' ' ' LYS . 81.3 mt-10 -149.63 132.29 15.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.721 0.296 . . . . 0.0 110.998 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 59.17 38.01 92.53 Favored Glycine 0 N--CA 1.452 -0.245 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.517 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.81 38.54 96.12 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.145 -178.561 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 88.4 m -150.94 128.43 11.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.883 0.373 . . . . 0.0 110.945 -176.703 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 5.9 t -78.06 126.7 31.2 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.951 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.517 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 22.0 pttp -166.4 149.37 7.03 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.712 -175.549 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.9 t70 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.258 -0.877 . . . . 0.0 109.434 174.753 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.859 0 N-CA-C 112.259 -0.337 . . . . 0.0 112.259 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.05 38.72 1.44 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.996 0.427 . . . . 0.0 111.097 -179.552 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -79.26 52.28 1.31 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.631 179.568 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -164.59 124.31 1.94 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.325 178.144 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 17.9 p -169.14 133.61 1.45 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.308 179.627 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -83.56 42.73 0.85 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.947 0.403 . . . . 0.0 111.311 -178.612 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 7.4 t -89.5 125.22 35.1 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.902 0.382 . . . . 0.0 110.164 179.443 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 70.8 37.57 66.18 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.967 -0.56 . . . . 0.0 113.025 179.41 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 71.8 t -100.4 112.11 63.77 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.632 0.253 . . . . 0.0 110.401 177.743 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.13 125.95 13.73 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 122.679 2.253 . . . . 0.0 111.839 -179.934 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 55.4 t -82.2 123.99 38.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.239 178.585 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 17.1 m -75.3 -45.49 39.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.047 0.451 . . . . 0.0 110.156 179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -164.4 118.9 1.42 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.718 175.67 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 434' ' ' THR . . . . . 0.544 HG22 ' HG3' ' A' ' 435' ' ' GLN . 25.9 m -68.98 -62.85 1.2 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.563 -178.488 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 435' ' ' GLN . . . . . 0.544 ' HG3' HG22 ' A' ' 434' ' ' THR . 2.8 pp0? -179.28 133.79 0.12 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.155 177.867 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 13.5 p -93.61 -42.77 9.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.502 179.541 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 56.28 36.7 27.92 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.732 178.619 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 60.03 56.74 22.99 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.193 178.337 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 439' ' ' ALA . . . . . 0.456 ' HB3' ' HB ' ' A' ' 442' ' ' THR . . . 65.82 58.57 0.77 Allowed 'General case' 0 C--O 1.235 0.33 0 C-N-CA 122.62 0.368 . . . . 0.0 111.004 -177.328 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 72.64 -57.34 0.63 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.026 0.931 . . . . 0.0 112.302 -179.467 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.2 t -169.32 26.91 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.945 0.402 . . . . 0.0 110.606 179.288 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.456 ' HB ' ' HB3' ' A' ' 439' ' ' ALA . 54.7 m -74.39 -46.74 38.4 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.622 175.181 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 57.46 55.43 5.72 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -174.864 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.634 ' HB2' ' HB2' ' A' ' 447' ' ' LYS . 22.2 pt-20 -70.12 57.43 0.16 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.778 -172.287 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -64.79 -35.89 82.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.403 178.018 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.525 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 12.6 t -75.21 -17.17 60.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.15 -177.541 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 444' ' ' GLU . 17.9 tttp -54.59 124.69 17.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.057 0.455 . . . . 0.0 111.089 -176.029 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 83.07 26.99 42.31 Favored Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.51 -0.768 . . . . 0.0 114.647 173.277 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.894 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 42.6 mtpt -84.05 -25.78 29.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.049 0.925 . . . . 0.0 109.226 170.989 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 96.19 141.14 11.65 Favored Glycine 0 C--O 1.215 -1.071 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.619 -177.825 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -45.34 -43.74 11.1 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -171.717 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -57.89 -43.69 86.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.062 0.458 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.72 ' OD2' ' HE2' ' A' ' 449' ' ' LYS . 23.6 t0 -81.5 -45.3 16.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.332 179.524 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.894 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 70.9 m -71.64 64.58 0.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.892 1.277 . . . . 0.0 111.331 174.986 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -65.72 145.4 56.06 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.817 -178.102 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.0 m -56.2 -48.37 97.01 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -175.77 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.3 Cg_endo -62.31 -33.05 81.6 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 121.491 1.461 . . . . 0.0 111.712 177.94 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -79.96 -40.97 26.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.145 -178.469 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 97.9 m -146.14 142.24 28.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.512 -176.308 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -75.2 125.21 28.49 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.851 0.358 . . . . 0.0 110.791 179.367 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.705 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 26.9 t-105 -96.44 115.93 28.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.696 178.966 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -89.07 -47.37 8.15 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.922 0.391 . . . . 0.0 110.907 -178.381 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.76 65.85 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 82.69 37.94 12.85 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.513 -174.137 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -167.56 136.7 2.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.739 0.304 . . . . 0.0 110.393 178.569 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.705 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.0 OUTLIER -102.15 138.9 38.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.194 -176.405 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -172.93 -173.29 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.919 0.39 . . . . 0.0 110.614 176.796 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 31.7 t70 . . . . . 0 C--O 1.248 1.002 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.33 176.404 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 112.088 -0.405 . . . . 0.0 112.088 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 4.1 m 58.73 38.49 24.89 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.547 0.689 . . . . 0.0 110.447 -179.661 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -102.23 138.17 39.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.454 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -145.03 43.16 1.32 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.883 -178.802 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 8.6 t 62.15 -150.14 0.37 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.424 -178.814 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 426' ' ' LYS . . . . . 0.522 ' HD3' ' N ' ' A' ' 426' ' ' LYS . 0.0 OUTLIER -166.27 133.56 2.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -177.033 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 72.3 m 66.41 140.4 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.543 0.687 . . . . 0.0 112.04 -178.31 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -65.71 131.09 34.27 Favored Glycine 0 N--CA 1.447 -0.626 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.424 -177.561 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 7.5 p -167.82 126.85 1.02 Allowed Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.658 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -75.67 122.83 7.11 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.298 1.998 . . . . 0.0 111.738 -179.065 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 15.6 m -75.92 132.6 32.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.459 178.862 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 57.7 m 72.24 128.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.58 0.705 . . . . 0.0 111.462 -178.067 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -157.05 -53.03 0.08 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.485 178.873 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.29 123.58 3.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.526 174.885 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 435' ' ' GLN . . . . . 0.603 ' HG2' HG22 ' A' ' 436' ' ' THR . 1.6 pm0 -72.21 -29.93 64.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.207 0.527 . . . . 0.0 109.949 177.941 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 436' ' ' THR . . . . . 0.603 HG22 ' HG2' ' A' ' 435' ' ' GLN . 10.7 t -167.79 134.4 2.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.177 178.407 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -164.77 140.2 5.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.872 0.368 . . . . 0.0 110.737 -175.244 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 162.98 -46.04 0.33 Allowed Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.242 179.269 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 58.2 50.37 9.94 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.377 0.608 . . . . 0.0 110.221 -176.879 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -157.19 147.94 21.47 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.523 -176.293 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.8 m 70.53 57.51 0.25 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.863 0.84 . . . . 0.0 110.488 -176.675 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 445' ' ' LYS . 11.4 m -82.79 59.11 4.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.43 175.971 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -69.04 -90.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.505 -170.797 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 447' ' ' LYS . 37.7 tt0 -77.05 24.86 0.16 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -172.385 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.511 ' HB2' HG22 ' A' ' 442' ' ' THR . 13.6 mmmm -82.97 -36.29 25.24 Favored 'General case' 0 C--N 1.311 -1.109 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 163.725 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.471 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 57.6 m -106.4 -36.15 6.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.498 176.201 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 444' ' ' GLU . 19.5 tptm -64.74 128.38 35.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.113 0.482 . . . . 0.0 110.999 -175.592 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.78 22.2 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.496 -0.774 . . . . 0.0 113.25 177.436 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 446' ' ' CYS . 43.4 mtpt -99.04 -48.82 4.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.128 0.489 . . . . 0.0 110.406 174.127 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 102.75 153.61 24.6 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -175.93 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.04 -39.92 83.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.88 0.34 . . . . 0.0 111.434 -177.499 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -86.57 37.6 0.75 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.249 0.547 . . . . 0.0 111.08 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -157.06 -45.93 0.07 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.333 -0.848 . . . . 0.0 108.889 177.513 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.1 t -63.22 115.91 4.96 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.199 175.003 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.477 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 94.8 mttt -101.74 141.06 35.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.573 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.487 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 22.1 m -56.13 -50.47 87.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.282 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 456' ' ' SER . 32.8 Cg_endo -63.33 -31.64 73.11 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.535 1.49 . . . . 0.0 110.942 177.339 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.477 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 14.6 t70 -71.32 -52.38 19.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.715 179.56 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.493 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 70.8 m -156.65 147.52 21.86 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -178.8 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -81.1 122.87 27.88 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.817 -176.345 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -87.56 106.64 18.14 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 174.383 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -146.62 130.31 16.99 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -174.664 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.18 32.42 84.12 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.788 -175.016 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.48 24.01 69.02 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.282 -177.479 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 57.0 m -132.18 133.75 44.57 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 120.797 0.332 . . . . 0.0 110.459 -177.65 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 31.2 t -88.96 118.77 28.93 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.343 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -161.72 144.61 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -174.587 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' A' ' 459' ' ' CYS . 9.8 t70 . . . . . 0 C--O 1.245 0.844 0 O-C-N 124.311 1.007 . . . . 0.0 110.972 -179.26 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.741 0 N-CA-C 112.004 -0.438 . . . . 0.0 112.004 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 5.1 p -67.12 -48.33 68.42 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.738 0.304 . . . . 0.0 110.804 179.256 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -75.16 139.7 42.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.338 177.004 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -75.4 56.79 0.87 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.967 0.413 . . . . 0.0 111.726 -178.556 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.8 m -66.83 132.37 47.87 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.334 178.919 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -70.82 124.27 23.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.351 0.596 . . . . 0.0 111.045 -178.39 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 22.7 t -90.82 -143.92 0.18 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.234 179.016 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -70.88 110.65 3.35 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 172.953 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 21.5 m -62.9 132.27 94.85 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-O 121.027 0.442 . . . . 0.0 111.483 -173.729 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -70.86 137.44 32.26 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.831 2.354 . . . . 0.0 112.098 -178.459 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 29.7 m -66.85 148.24 12.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.239 177.54 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 14.6 t -56.9 137.17 55.6 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 -178.719 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -58.93 129.3 41.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.875 -175.491 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 17.3 m -136.63 139.25 41.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.279 -177.504 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -51.97 -57.29 9.89 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.715 -175.573 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 4.8 t -175.46 66.27 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.589 0.709 . . . . 0.0 110.063 -175.954 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 60.52 -129.33 0.93 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.413 -176.502 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -86.2 38.02 3.09 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.735 178.375 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 70.25 139.46 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 123.478 0.711 . . . . 0.0 111.796 -179.176 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -83.04 42.57 0.81 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.968 177.43 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.6 p -64.77 -41.88 95.53 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 173.756 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.403 HG21 ' HG2' ' A' ' 467' ' ' LYS . 5.2 m -70.97 133.31 46.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.765 171.044 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -58.76 140.71 54.55 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 123.176 0.297 . . . . 0.0 110.54 179.357 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.726 ' HA ' ' HB2' ' A' ' 447' ' ' LYS . 2.1 mp0 -79.33 27.92 0.25 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.72 -175.892 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -71.92 -34.2 68.89 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 168.063 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.559 ' O ' ' HE2' ' A' ' 449' ' ' LYS . 57.9 m -113.38 -49.77 2.89 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 113.933 -1.485 . . . . 0.0 109.731 172.586 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.726 ' HB2' ' HA ' ' A' ' 444' ' ' GLU . 63.5 tttp 59.08 144.97 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.887 0.875 . . . . 0.0 112.844 176.706 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.553 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . -73.14 51.86 1.7 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.857 179.311 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.559 ' HE2' ' O ' ' A' ' 446' ' ' CYS . 33.6 mtmt -74.48 -152.21 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 179.773 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -83.26 156.23 33.59 Favored Glycine 0 N--CA 1.443 -0.88 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 174.234 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -41.07 98.53 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.685 0.279 . . . . 0.0 111.301 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -69.05 -34.05 74.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.835 0.35 . . . . 0.0 110.51 179.942 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.33 -51.83 27.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.663 176.986 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 16.0 t -53.67 129.84 34.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.032 174.953 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.97 116.81 23.58 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 173.88 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.571 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 25.0 m -65.93 -47.04 64.92 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.413 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.1 Cg_endo -57.98 -38.44 92.05 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.667 1.578 . . . . 0.0 111.645 177.591 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -76.76 -48.22 19.34 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.175 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 60.6 m -130.4 142.54 50.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 111.189 -175.178 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -76.95 133.98 39.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.072 0.463 . . . . 0.0 110.99 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -102.98 119.84 39.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.479 176.512 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -159.94 143.68 14.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.686 0.279 . . . . 0.0 110.674 178.684 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.17 32.1 79.33 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.285 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.13 41.82 99.63 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.975 179.375 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.7 t -160.4 146.89 15.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.012 0.434 . . . . 0.0 110.496 178.963 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.706 ' HB3' ' O ' ' A' ' 447' ' ' LYS . 20.6 t -97.48 121.25 39.16 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.711 -176.748 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.403 ' HG2' HG21 ' A' ' 442' ' ' THR . 49.8 mtmt -133.56 141.85 47.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.792 0.33 . . . . 0.0 111.576 -175.869 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.519 -0.753 . . . . 0.0 109.718 175.036 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.847 0 N-CA-C 112.182 -0.367 . . . . 0.0 112.182 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 4.8 m -81.73 53.81 2.24 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.358 0.599 . . . . 0.0 110.519 179.111 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -73.03 -46.04 54.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.517 -178.262 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -84.31 140.24 31.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.082 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 6.9 p -126.88 -84.63 0.61 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.127 177.4 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp 55.55 61.16 2.96 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.438 0.637 . . . . 0.0 110.361 176.083 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 12.3 p -69.39 -20.48 63.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.771 -175.613 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -63.1 171.46 12.54 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.053 -0.594 . . . . 0.0 112.341 179.287 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 46.0 t -67.36 126.07 92.01 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 178.557 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -63.24 147.48 93.84 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.679 2.252 . . . . 0.0 112.494 -178.174 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 15.7 t -77.85 59.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.467 0.651 . . . . 0.0 110.04 178.186 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 8.8 m -70.86 -28.7 64.77 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.204 -175.615 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 47.36 -135.62 0.95 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.716 0.806 . . . . 0.0 110.833 -175.874 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 6.2 t 46.61 39.07 6.38 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.593 0.757 . . . . 0.0 111.485 179.149 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -74.54 -45.27 46.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.583 178.097 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 58.2 m -64.84 -51.42 62.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.64 -177.689 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -170.13 143.32 2.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.812 0.339 . . . . 0.0 111.367 -179.991 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -171.37 130.09 1.9 Allowed Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.811 178.654 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 58.59 42.96 19.82 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.136 0.493 . . . . 0.0 111.051 -178.106 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -76.32 159.35 30.63 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.917 179.469 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 17.9 m -54.55 122.97 11.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.494 -176.772 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 15.4 t -175.88 -24.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.868 -178.595 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 75.96 131.46 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.517 0.727 . . . . 0.0 110.666 -174.0 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 1.033 ' HG2' ' HB2' ' A' ' 467' ' ' LYS . 1.2 tp10 57.94 27.07 14.19 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.337 -176.248 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.703 ' HE2' ' HB2' ' A' ' 468' ' ' ASP . 16.3 ttpt 51.15 21.33 1.04 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.426 176.894 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.48 ' SG ' ' HD2' ' A' ' 449' ' ' LYS . 0.5 OUTLIER -172.32 -26.21 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -174.356 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -55.1 113.0 1.19 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.909 0.385 . . . . 0.0 110.982 -174.713 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.83 -30.86 3.03 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.295 -174.51 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.48 ' HD2' ' SG ' ' A' ' 446' ' ' CYS . 96.0 mttt -63.93 140.41 58.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.733 -0.233 . . . . 0.0 110.996 178.429 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.52 172.67 47.89 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 171.818 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.82 -41.73 78.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.277 0.539 . . . . 0.0 111.101 -178.594 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -71.57 -41.75 68.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.487 -178.444 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.62 -35.57 80.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.293 0.568 . . . . 0.0 110.451 177.008 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 15.9 t -68.37 109.16 3.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.522 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -85.18 126.92 34.04 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.528 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -59.4 -49.58 91.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -175.725 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.4 Cg_endo -61.0 -33.21 92.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.716 1.611 . . . . 0.0 111.67 178.659 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -78.04 -45.39 23.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.505 -179.681 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 57.6 m -146.87 143.14 28.34 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 -178.901 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 467' ' ' LYS . 16.4 ptpt -86.41 135.54 33.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.205 0.526 . . . . 0.0 110.798 178.237 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.403 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 77.2 t-105 -95.28 121.14 36.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.52 -175.859 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -81.52 -135.72 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.485 178.56 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.81 -43.1 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.317 177.1 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.28 44.68 0.55 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.549 -0.621 . . . . 0.0 111.549 179.542 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.6 t -162.29 136.19 6.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.368 0.604 . . . . 0.0 110.554 178.684 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 35.5 t -96.29 134.9 38.84 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.47 -0.786 . . . . 0.0 108.943 178.415 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 1.033 ' HB2' ' HG2' ' A' ' 444' ' ' GLU . 0.0 OUTLIER -153.0 135.07 14.8 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.911 -0.716 . . . . 0.0 111.715 -178.113 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.703 ' HB2' ' HE2' ' A' ' 445' ' ' LYS . 23.2 t70 . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.486 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.712 0 N-CA-C 112.115 -0.394 . . . . 0.0 112.115 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 69.9 m -69.52 126.16 28.9 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.61 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm 69.48 133.31 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.91 0.756 . . . . 0.0 110.778 -174.746 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -60.42 -49.69 76.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.404 179.422 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 36.5 p 44.85 48.25 9.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.102 176.455 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -173.36 -45.51 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.474 178.605 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 15.0 m -74.55 115.5 14.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.016 -179.312 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 428' ' ' GLY . . . . . 0.499 ' O ' HG22 ' A' ' 429' ' ' VAL . . . 74.75 -60.26 2.53 Favored Glycine 0 CA--C 1.52 0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 113.494 177.092 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 428' ' ' GLY . 5.9 m 55.9 135.53 0.02 OUTLIER Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 125.373 1.469 . . . . 0.0 113.512 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 2.9 Cg_exo -76.21 35.2 0.45 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 123.195 2.597 . . . . 0.0 112.664 -178.974 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 52.1 t -94.58 114.8 31.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.242 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 9.9 t -167.06 138.81 3.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.35 -175.925 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -143.55 36.27 1.32 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.139 0.495 . . . . 0.0 110.327 -179.458 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 2.3 p -77.68 50.78 0.86 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.484 177.459 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -134.07 -49.61 0.81 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 176.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 9.5 p -79.94 -50.4 10.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.471 170.855 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -84.45 131.58 34.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.868 173.103 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -171.17 39.94 0.18 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.395 -0.907 . . . . 0.0 112.342 -178.492 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 68.78 142.66 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.609 0.719 . . . . 0.0 112.058 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 39.4 p30 -82.6 27.97 0.49 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.155 -177.297 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.2 m -94.51 -54.66 3.43 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 173.434 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 442' ' ' THR . . . . . 0.992 HG22 ' HA ' ' A' ' 445' ' ' LYS . 7.3 m -100.35 52.83 0.89 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.288 174.094 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -62.24 -56.08 22.1 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.545 -174.601 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.5 25.84 5.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.363 0.602 . . . . 0.0 110.494 177.92 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.992 ' HA ' HG22 ' A' ' 442' ' ' THR . 29.3 mtpp 53.1 31.74 11.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.466 -1.243 . . . . 0.0 112.363 177.674 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 2.4 t 66.31 7.49 4.95 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.488 0.715 . . . . 0.0 110.86 175.643 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 62.0 tttp -75.76 128.17 34.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.176 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 133.22 -37.93 1.93 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.281 179.3 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.271 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.33 179.42 25.08 Favored Glycine 0 C--O 1.226 -0.359 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.7 175.889 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.98 -43.75 94.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.219 0.51 . . . . 0.0 111.558 -176.546 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.93 -40.47 91.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.044 0.45 . . . . 0.0 110.354 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -69.95 -41.01 75.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.912 -179.62 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.5 114.12 2.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.098 -177.355 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 49.8 mtmt -72.6 117.23 14.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 176.048 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.507 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.7 t -64.59 -50.35 65.68 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -173.883 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 456' ' ' SER . 29.6 Cg_endo -61.47 -29.81 85.68 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.632 1.555 . . . . 0.0 111.649 178.514 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.562 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 1.0 OUTLIER -85.35 -40.91 15.97 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.221 -176.032 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.5 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 9.2 m -137.88 144.66 41.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.678 0.275 . . . . 0.0 110.452 -174.629 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 460' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 460' ' ' LYS . 4.4 mptp? -80.9 148.02 30.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.089 0.471 . . . . 0.0 110.532 178.67 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -107.43 123.02 47.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.454 178.874 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.515 ' HG2' ' H ' ' A' ' 463' ' ' GLY . 22.9 tt0 -85.33 -136.67 0.06 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 177.268 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 463' ' ' GLY . . . . . 0.515 ' H ' ' HG2' ' A' ' 462' ' ' GLU . . . -73.88 -42.76 36.93 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 110.904 -0.879 . . . . 0.0 110.904 175.132 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.99 42.59 0.48 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 177.456 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 91.2 m -148.47 129.19 14.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.811 0.339 . . . . 0.0 110.943 -176.96 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.547 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 8.7 t -83.6 135.79 34.48 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.139 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.727 ' HA ' ' O ' ' A' ' 445' ' ' LYS . 60.5 pttt -159.78 134.89 8.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.467 0.651 . . . . 0.0 111.887 -179.659 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.684 178.12 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.613 0 N-CA-C 111.731 -0.548 . . . . 0.0 111.731 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 17.0 m 56.41 44.69 24.02 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.67 0.748 . . . . 0.0 110.964 178.812 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -166.14 35.66 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.194 177.682 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -165.29 129.54 2.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.179 178.619 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 43.6 m -151.71 -37.78 0.12 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.995 0.426 . . . . 0.0 110.328 -177.886 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -150.93 -136.57 0.07 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.833 178.966 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 10.0 t 62.33 44.87 7.08 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.425 0.631 . . . . 0.0 109.958 179.999 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 177.15 136.13 2.36 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.501 -178.779 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.482 HG22 HG22 ' A' ' 431' ' ' VAL . 11.5 p -136.51 130.22 17.91 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-O 120.751 0.31 . . . . 0.0 110.237 -178.6 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 52.1 Cg_exo -57.3 -35.39 98.88 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.964 2.443 . . . . 0.0 112.742 -175.933 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.796 ' HA ' ' HG2' ' A' ' 435' ' ' GLN . 27.5 m -84.43 38.16 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-O 121.129 0.49 . . . . 0.0 111.377 179.193 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 14.6 t -69.47 143.42 53.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.668 178.72 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 94.2 mm-40 63.6 40.58 7.91 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.998 -176.238 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 1.4 m 58.32 26.31 13.83 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.394 -178.16 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 435' ' ' GLN . . . . . 0.796 ' HG2' ' HA ' ' A' ' 431' ' ' VAL . 0.5 OUTLIER 64.73 124.6 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.391 -176.614 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 8.8 t -161.23 38.21 0.14 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.579 0.704 . . . . 0.0 109.847 178.777 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -158.81 33.89 0.22 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.231 177.525 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -73.02 -42.88 42.76 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.044 179.743 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -155.45 138.08 15.13 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 177.975 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -61.44 132.27 52.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.419 -178.459 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 17.1 p 50.53 39.54 21.32 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.344 0.658 . . . . 0.0 112.03 -179.147 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 90.9 m 70.28 -52.7 0.65 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.422 0.689 . . . . 0.0 112.266 178.742 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 55.25 -141.21 0.87 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -176.514 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -103.73 33.16 3.51 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.777 175.57 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 44.0 tttp -71.25 -36.5 71.79 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.717 171.633 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.578 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 63.8 m -123.24 -32.89 3.37 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.592 178.37 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -71.85 125.67 27.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 110.595 -177.004 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 130.08 -29.57 3.68 Favored Glycine 0 N--CA 1.441 -0.971 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.315 -178.803 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.544 ' HB2' ' CB ' ' A' ' 453' ' ' ASP . 9.8 pttm -97.45 139.11 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.638 178.942 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.22 -168.88 14.54 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.418 -174.76 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.32 -40.87 90.2 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 122.658 0.383 . . . . 0.0 111.484 -176.785 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -62.5 -41.52 98.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.154 0.502 . . . . 0.0 110.119 178.071 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.544 ' CB ' ' HB2' ' A' ' 449' ' ' LYS . 90.6 m-20 -73.73 -41.61 62.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.528 -179.411 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 7.8 t -63.41 118.76 8.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.84 -176.038 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -156.65 172.97 17.64 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.545 -178.779 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.434 ' OG ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 t 68.58 147.61 0.11 Allowed Pre-proline 0 C--O 1.226 -0.159 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.178 175.11 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.434 ' HD2' ' OG ' ' A' ' 456' ' ' SER . 27.3 Cg_endo -61.64 -1.56 2.11 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.507 2.138 . . . . 0.0 111.748 177.684 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.35 -37.28 68.88 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.1 174.949 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.49 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 79.8 m -135.64 131.86 36.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.367 177.081 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -105.96 133.39 50.75 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.979 -177.818 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -85.82 132.68 34.06 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 174.689 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -157.31 128.98 6.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.056 -0.257 . . . . 0.0 111.01 -178.132 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.54 -70.59 0.37 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.015 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -175.57 31.69 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 177.471 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.1 m -151.23 134.85 16.32 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -177.014 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 17.0 t -84.97 125.82 33.01 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.049 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.491 ' HA ' ' HB2' ' A' ' 446' ' ' CYS . 22.5 pttp -156.79 144.01 18.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.671 0.272 . . . . 0.0 111.065 -176.247 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.887 -176.987 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.945 0 N-CA-C 111.762 -0.535 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 21.9 p -82.34 -140.55 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.654 0.264 . . . . 0.0 111.2 178.917 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -157.63 -54.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.871 0.367 . . . . 0.0 110.235 179.417 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -88.62 -43.9 11.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.861 176.724 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 13.2 m 67.71 128.76 0.02 OUTLIER 'General case' 0 C--O 1.235 0.317 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.275 179.892 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 3.2 pptp? -73.56 -26.07 60.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.307 178.985 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 23.5 m 59.73 86.66 0.09 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.654 175.148 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -178.44 127.46 1.16 Allowed Glycine 0 N--CA 1.442 -0.917 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.618 178.121 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.433 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 15.6 m -62.34 137.66 96.1 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-O 120.817 0.341 . . . . 0.0 110.848 -178.9 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.569 ' HB2' HG23 ' A' ' 432' ' ' THR . 24.3 Cg_exo -65.59 142.9 72.99 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.676 2.25 . . . . 0.0 112.064 -177.609 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 20.3 t -77.75 67.01 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.327 0.584 . . . . 0.0 109.633 177.228 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 432' ' ' THR . . . . . 0.569 HG23 ' HB2' ' A' ' 430' ' ' PRO . 5.5 p -73.55 59.64 0.63 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.013 -174.707 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -144.03 -45.67 0.26 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.86 177.402 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 8.6 t -87.16 132.43 33.86 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 171.764 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -171.13 124.65 0.63 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.591 -176.184 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 14.2 t 40.35 47.83 2.26 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.422 1.089 . . . . 0.0 112.487 179.075 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 70.96 -48.4 0.67 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.916 0.886 . . . . 0.0 112.611 177.504 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 69.99 -140.61 33.09 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.978 -179.451 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 52.45 54.5 10.56 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.842 0.353 . . . . 0.0 111.699 177.783 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -71.15 -50.35 34.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.975 0.417 . . . . 0.0 111.254 -176.963 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 6.9 m -77.26 -54.4 6.53 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.187 -176.754 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 15.2 t -85.19 130.05 34.68 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.896 0.379 . . . . 0.0 110.508 178.432 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -82.93 39.45 0.63 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.919 0.39 . . . . 0.0 110.639 179.106 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.94 ' HG3' ' HB3' ' A' ' 447' ' ' LYS . 30.9 tt0 54.81 43.5 29.94 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.703 0.763 . . . . 0.0 110.605 -178.438 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -64.21 -38.93 92.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.411 176.55 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.789 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 73.2 m -122.56 -11.03 8.32 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 113.98 -1.464 . . . . 0.0 112.642 -166.315 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.94 ' HB3' ' HG3' ' A' ' 444' ' ' GLU . 85.2 tttt -67.42 105.67 1.87 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.104 179.872 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 137.52 -28.19 2.79 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.213 -179.643 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -86.6 154.34 21.12 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.416 -176.902 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.57 177.44 30.06 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.83 -176.253 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.01 -50.74 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.844 -0.209 . . . . 0.0 110.973 -177.9 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -68.18 -31.07 70.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.936 0.398 . . . . 0.0 110.535 179.55 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.55 -34.73 72.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.02 178.571 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 48.9 t -60.12 116.76 4.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.23 179.842 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.492 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 35.9 mtmm -81.04 124.78 29.46 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.709 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.425 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 9.6 m -62.93 -54.08 49.92 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -172.418 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.5 Cg_endo -62.08 -28.37 80.05 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.475 1.45 . . . . 0.0 111.235 178.976 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.492 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 45.3 t0 -75.03 -50.96 14.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.972 178.089 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.498 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 98.2 m -148.54 148.39 30.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.404 0.621 . . . . 0.0 111.509 -175.169 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -92.35 139.58 30.45 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.282 177.241 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 48.9 t-105 -77.2 119.78 21.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.158 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -149.3 130.42 14.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.84 0.352 . . . . 0.0 110.454 -176.587 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.75 38.27 91.66 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.377 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.95 84.01 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.258 -0.496 . . . . 0.0 112.313 -177.815 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 85.9 m -150.82 135.84 17.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.695 0.283 . . . . 0.0 110.287 -177.002 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.789 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 20.0 t -78.63 124.94 28.7 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -161.39 134.28 6.21 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.137 0.494 . . . . 0.0 111.39 -174.907 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 468' ' ' ASP . . . . . 0.433 ' HB3' ' HA ' ' A' ' 459' ' ' CYS . 29.4 p-10 . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.642 177.91 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.714 0 N-CA-C 112.191 -0.364 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 6.6 m -67.99 129.73 40.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.595 0.236 . . . . 0.0 110.388 -179.704 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.07 35.3 0.14 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.927 -177.198 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 69.6 145.93 0.06 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.403 -179.356 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.7 m -57.08 139.15 53.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.893 -178.152 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -54.08 124.68 16.34 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.203 -177.466 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 51.0 m -160.36 129.33 4.9 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.16 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -152.21 36.34 0.82 Allowed Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.084 -177.521 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 7.3 p -177.12 126.9 0.3 Allowed Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 177.067 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 18.4 Cg_exo -68.52 -34.87 18.89 Favored 'Trans proline' 0 C--O 1.234 0.301 0 C-N-CA 122.772 2.314 . . . . 0.0 111.535 -177.625 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 14.2 t 64.48 47.9 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.634 -176.876 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 23.5 m -69.29 -39.42 78.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.492 177.264 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.2 tm0? -134.58 118.59 17.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.056 -0.975 . . . . 0.0 108.433 174.174 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 12.3 m -63.95 116.85 6.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.606 -176.093 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -54.74 -49.63 70.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.858 -177.434 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 7.9 m 72.56 -38.72 0.43 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 122.864 0.466 . . . . 0.0 112.059 177.097 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 61.16 -139.01 0.54 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.982 0.513 . . . . 0.0 111.285 178.635 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 84.18 140.23 4.48 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.988 -177.686 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -156.52 134.13 10.87 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 -179.757 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 60.68 40.55 16.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.837 -176.594 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 2.7 m -75.24 -43.14 53.26 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.422 0.63 . . . . 0.0 109.552 176.79 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 12.9 m -158.27 125.34 4.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.337 179.47 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -64.86 -37.81 88.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.032 0.444 . . . . 0.0 110.451 -179.572 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.432 ' HG2' ' HB3' ' A' ' 447' ' ' LYS . 86.1 mt-10 63.36 42.64 6.68 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.002 -0.999 . . . . 0.0 112.448 175.726 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -79.37 -34.75 41.71 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 170.065 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.881 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 81.9 m -97.82 -44.42 6.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.425 174.174 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 1.1 tmtp? -52.76 127.41 23.18 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.543 -178.795 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 108.89 -28.57 11.03 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.606 -178.868 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.881 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 57.0 mtmt -72.28 144.68 48.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.793 0.296 . . . . 0.0 111.132 -178.888 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.84 175.25 34.92 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 175.935 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.52 -37.09 74.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 117.346 0.573 . . . . 0.0 111.459 -177.253 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -68.6 -41.67 79.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.234 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.613 ' HB3' ' HD2' ' A' ' 449' ' ' LYS . 1.1 m-20 -75.96 -36.87 59.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 110.56 178.852 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.48 ' SG ' ' N ' ' A' ' 455' ' ' LYS . 36.9 t -77.55 -157.73 0.1 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.351 179.589 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 455' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 454' ' ' CYS . 27.7 mmmt 61.36 49.67 5.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.862 0.839 . . . . 0.0 110.749 -175.282 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.46 ' C ' ' H ' ' A' ' 458' ' ' ASP . 0.9 OUTLIER -71.77 171.72 8.59 Favored Pre-proline 0 C--N 1.31 -1.127 0 CA-C-N 114.438 -1.255 . . . . 0.0 108.974 176.06 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 456' ' ' SER . 71.8 Cg_endo -77.57 29.07 0.43 Allowed 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.102 1.868 . . . . 0.0 111.097 175.949 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 458' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' A' ' 456' ' ' SER . 49.6 t0 -158.52 -49.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.489 -179.121 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 69.3 m -79.34 137.54 37.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.991 -179.484 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -115.22 160.48 19.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.306 0.574 . . . . 0.0 111.594 -178.563 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.449 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 37.1 t-105 -91.46 136.27 33.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.79 179.202 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.54 ' O ' HG22 ' A' ' 465' ' ' THR . 36.8 tt0 -128.24 75.38 1.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.944 0.402 . . . . 0.0 111.691 -177.59 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 60.78 57.96 16.19 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.756 175.383 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 78.99 40.79 15.69 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.947 178.762 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.54 HG22 ' O ' ' A' ' 462' ' ' GLU . 6.3 t -166.87 143.12 4.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 175.334 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.621 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 36.6 t -98.91 139.73 34.13 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.576 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 21.9 pttp -153.54 152.13 30.58 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.993 0.425 . . . . 0.0 111.103 -178.363 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.337 175.251 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.751 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 422' ' ' THR . . . . . 0.41 HG21 ' HA ' ' A' ' 430' ' ' PRO . 52.7 p 54.06 115.02 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.245 1.018 . . . . 0.0 112.731 178.317 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 423' ' ' LYS . . . . . 0.404 ' HD2' ' N ' ' A' ' 423' ' ' LYS . 4.1 mptp? -67.63 137.36 55.55 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.118 177.725 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -61.28 126.93 29.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.117 -176.606 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 10.9 t 56.72 50.48 12.53 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.692 -179.362 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -153.14 139.26 18.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.369 -179.244 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 13.0 m -65.49 137.66 57.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.605 -176.792 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -174.33 -148.1 6.4 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.828 178.845 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 25.4 t -123.9 104.07 33.3 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-O 120.805 0.336 . . . . 0.0 110.575 179.488 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.41 ' HA ' HG21 ' A' ' 422' ' ' THR . 15.5 Cg_exo -69.29 -43.67 2.9 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.927 2.418 . . . . 0.0 112.023 -179.036 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 22.1 m -71.16 143.63 14.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.411 -179.856 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 42.3 m -72.9 -40.12 65.81 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.665 179.062 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -67.34 135.03 52.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.906 178.44 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 14.6 m -79.67 74.79 6.35 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.461 178.549 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 95.0 mm-40 62.21 -130.22 0.62 Allowed 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.765 -176.809 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 13.2 p -81.84 -17.87 45.93 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.417 179.515 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 63.45 -143.29 0.34 Allowed 'General case' 0 C--O 1.231 0.103 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.752 -177.478 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -70.34 134.5 24.75 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.288 179.633 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -161.77 128.5 3.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.632 0.253 . . . . 0.0 110.944 -179.812 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -72.18 -41.67 66.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.809 0.814 . . . . 0.0 109.827 177.804 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 54.1 m -165.51 -41.55 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.338 -1.301 . . . . 0.0 107.686 -179.963 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.3 126.33 35.82 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.847 172.215 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -61.38 -41.39 97.03 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.32 0.581 . . . . 0.0 110.433 -179.61 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 447' ' ' LYS . 8.0 pt-20 -59.98 108.37 0.76 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.687 179.629 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 17.1 mtmm -75.91 49.0 0.51 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.455 177.572 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.753 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 59.0 m -141.85 -23.78 0.7 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.069 -177.385 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.454 ' HB2' ' HG3' ' A' ' 444' ' ' GLU . 22.7 tptp -56.01 107.71 0.38 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.31 -173.65 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 78.32 56.07 3.8 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.673 -0.694 . . . . 0.0 113.875 177.297 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.622 ' HG2' ' O ' ' A' ' 446' ' ' CYS . 14.5 ptpt -129.57 166.79 19.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.219 0.51 . . . . 0.0 110.692 173.451 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 165.11 54.68 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.086 -177.781 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.45 -35.11 78.57 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.318 0.247 . . . . 0.0 111.104 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 39.25 0.71 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.643 0.735 . . . . 0.0 110.388 176.694 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -156.28 -44.51 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.576 -178.566 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.48 129.46 39.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.039 176.507 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -106.73 117.76 34.91 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.325 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.51 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 26.1 t -56.95 -48.43 97.43 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -173.601 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.2 Cg_endo -58.01 -30.13 89.05 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.625 1.55 . . . . 0.0 112.187 -179.227 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -87.95 -45.08 10.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.156 -179.842 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.497 ' O ' ' HA ' ' A' ' 456' ' ' SER . 68.4 m -143.13 142.08 31.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.947 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -89.05 147.23 24.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.731 0.777 . . . . 0.0 112.008 -175.265 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -94.82 119.52 33.54 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.345 179.615 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -146.07 129.89 17.2 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.572 0.225 . . . . 0.0 110.756 -179.161 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.67 42.68 96.37 Favored Glycine 0 N--CA 1.454 -0.152 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.221 -178.929 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 57.18 34.71 67.52 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.061 -177.025 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 32.7 m -143.93 130.72 20.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.715 0.293 . . . . 0.0 110.874 -175.038 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.1 t -88.64 134.61 33.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.98 178.654 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -172.53 154.34 3.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 111.229 -179.448 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 7.6 t70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.306 -0.854 . . . . 0.0 109.478 175.057 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.534 -0.627 . . . . 0.0 111.534 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 422' ' ' THR . . . . . 0.434 ' HB ' ' H ' ' A' ' 423' ' ' LYS . 6.7 p -86.45 -142.94 0.1 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.771 0.286 . . . . 0.0 111.227 -179.628 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 423' ' ' LYS . . . . . 0.434 ' H ' ' HB ' ' A' ' 422' ' ' THR . 68.3 mttm 70.3 138.93 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.337 0.655 . . . . 0.0 111.29 -178.526 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -73.19 -20.14 60.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.886 -179.834 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 5.4 p -76.09 37.97 0.16 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -177.296 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -93.74 129.46 40.07 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 174.954 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.4 t -89.81 117.2 28.48 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.136 -179.952 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -77.17 -47.09 9.48 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.163 176.662 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 429' ' ' VAL . . . . . 0.455 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 62.1 t -75.88 132.32 74.65 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.347 -0.426 . . . . 0.0 110.178 175.528 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 430' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 8.1 Cg_exo -71.55 62.67 2.91 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 123.217 2.612 . . . . 0.0 111.913 178.896 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 431' ' ' VAL . . . . . 0.519 ' HA ' HG21 ' A' ' 436' ' ' THR . 15.4 m -72.74 48.69 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-O 121.185 0.516 . . . . 0.0 112.125 -176.823 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 8.9 t -77.25 135.93 38.49 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.124 176.494 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 70.95 144.25 0.06 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.268 -177.257 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 2.8 p -76.42 51.8 0.74 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.583 179.856 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -164.15 33.04 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.286 0.565 . . . . 0.0 110.345 -176.793 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 436' ' ' THR . . . . . 0.519 HG21 ' HA ' ' A' ' 431' ' ' VAL . 1.6 m -81.38 126.64 31.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.452 178.402 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -166.38 -39.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.638 0.256 . . . . 0.0 111.23 -179.675 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 68.41 44.69 72.58 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 -175.865 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -150.29 -45.67 0.13 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.823 0.344 . . . . 0.0 110.942 -176.614 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -75.0 118.99 18.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.757 179.771 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -32.93 74.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.85 177.777 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 3.6 t -147.36 131.0 16.86 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.481 177.209 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -82.75 47.16 1.16 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.138 -178.59 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.838 ' HG3' ' HB3' ' A' ' 447' ' ' LYS . 31.8 tt0 55.88 46.39 22.21 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 121.636 0.732 . . . . 0.0 111.043 179.332 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -34.02 53.51 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.455 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.796 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 70.8 m -110.72 -28.19 8.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.05 179.595 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.838 ' HB3' ' HG3' ' A' ' 444' ' ' GLU . 9.1 tmtm? -61.58 130.87 48.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -173.323 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.5 17.01 79.81 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.52 -0.763 . . . . 0.0 114.4 175.187 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 449' ' ' LYS . . . . . 0.796 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 50.8 mtmt -93.19 137.94 32.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 117.972 0.886 . . . . 0.0 110.327 173.868 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.47 166.18 51.29 Favored Glycine 0 C--O 1.223 -0.538 0 C-N-CA 121.018 -0.611 . . . . 0.0 111.854 178.622 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 451' ' ' GLU . . . . . 0.424 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 37.1 tt0 -59.26 -34.71 72.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.033 0.444 . . . . 0.0 111.635 -177.218 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -69.67 -44.38 70.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.803 0.335 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.54 -44.35 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.603 -179.015 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 454' ' ' CYS . . . . . 0.553 ' SG ' ' HE3' ' A' ' 449' ' ' LYS . 0.3 OUTLIER -80.29 115.9 20.08 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.305 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -87.95 148.05 24.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 178.773 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 456' ' ' SER . . . . . 0.493 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -62.96 -51.75 68.69 Favored Pre-proline 0 C--N 1.322 -0.606 0 O-C-N 123.347 0.404 . . . . 0.0 111.605 -179.845 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 457' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.1 Cg_endo -61.81 -30.98 85.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.599 1.533 . . . . 0.0 111.46 176.584 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -71.71 -47.99 50.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.008 178.357 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 459' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 63.4 m -148.55 143.12 26.42 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.157 -173.584 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.02 124.28 23.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.956 0.408 . . . . 0.0 110.781 -178.303 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 461' ' ' TRP . . . . . 0.583 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 60.3 t-105 -107.08 126.56 52.51 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.685 178.339 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 462' ' ' GLU . . . . . 0.884 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 21.3 tt0 -90.61 -60.5 1.9 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.975 0.417 . . . . 0.0 110.133 -179.176 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 176.55 40.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 178.286 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 147.55 -41.78 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -176.215 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.6 m -104.84 134.17 48.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.469 -0.365 . . . . 0.0 111.311 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 466' ' ' CYS . . . . . 0.583 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 1.8 t -101.09 145.1 29.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.971 178.666 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 467' ' ' LYS . . . . . 0.884 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 0.5 OUTLIER -148.16 140.17 24.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.123 0.487 . . . . 0.0 111.53 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 5.9 t70 . . . . . 0 C--O 1.251 1.158 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.507 179.676 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.419 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 57.0 m . . . . . 0 N--CA 1.451 -0.417 0 CA-C-O 121.428 0.633 . . . . 0.0 109.786 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 14.3 tptm -60.73 118.15 6.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.598 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.52 -25.87 8.88 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.146 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.596 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 68.4 mttm -69.33 144.02 53.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.61 0.243 . . . . 0.0 111.565 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -77.79 176.12 53.98 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 171.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -56.31 -44.34 79.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.858 0.329 . . . . 0.0 111.24 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -64.91 -40.63 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 47.2 m-20 -69.33 -43.62 73.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.711 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 8.7 t -60.93 111.32 1.62 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.733 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.661 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 95.0 mttt -82.95 127.03 33.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.554 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 69.8 m -61.39 -49.0 89.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -58.37 -28.3 84.45 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 121.796 1.664 . . . . 0.0 111.96 177.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.661 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 0.7 OUTLIER -86.87 -45.67 10.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.991 -178.219 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.1 m -140.77 146.63 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.73 -172.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.499 ' HG3' ' HG3' ' A' ' 462' ' ' GLU . 24.7 tptp -88.7 112.9 23.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.478 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -83.87 106.92 15.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.504 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 51.4 mt-10 -138.42 132.33 31.22 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.154 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.19 41.39 99.47 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.685 -0.688 . . . . 0.0 112.836 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.06 36.29 92.09 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.319 -0.467 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 89.1 m -149.97 129.23 12.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.787 0.327 . . . . 0.0 110.511 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 22.8 t -87.53 126.51 34.96 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.504 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 52.1 pttt -151.4 142.57 23.22 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.569 0.699 . . . . 0.0 112.146 -174.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 C--O 1.247 0.972 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.446 175.791 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.686 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 42.5 m . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 121.31 0.576 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -53.0 128.46 27.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.266 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 100.33 -22.76 38.59 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.023 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -71.04 137.46 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.959 0.409 . . . . 0.0 112.097 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.22 176.75 49.5 Favored Glycine 0 N--CA 1.444 -0.788 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 171.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -63.89 -43.4 96.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 117.193 0.497 . . . . 0.0 110.413 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 10.2 mptt -82.45 37.5 0.51 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.368 0.604 . . . . 0.0 111.016 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.73 -41.66 0.1 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.6 t -54.68 108.52 0.4 Allowed 'General case' 0 C--O 1.237 0.406 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.463 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.473 ' HB3' ' HB2' ' A' ' 458' ' ' ASP . 0.3 OUTLIER -71.11 126.97 31.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.108 178.44 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.524 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.6 m -67.55 -46.99 47.44 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.838 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 456' ' ' SER . 24.8 Cg_endo -61.83 -36.21 74.44 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.187 1.258 . . . . 0.0 111.772 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.473 ' HB2' ' HB3' ' A' ' 455' ' ' LYS . 9.3 m-20 -79.47 -39.82 31.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.177 -178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 10.3 m -133.35 -148.63 0.34 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.962 -171.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.537 ' HG3' ' HB2' ' A' ' 467' ' ' LYS . 9.9 ptpp? -167.51 149.13 5.63 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -97.94 133.19 42.76 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.506 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -139.86 122.69 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.41 -92.66 0.13 Allowed Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 -176.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -147.62 36.07 1.18 Allowed Glycine 0 N--CA 1.439 -1.147 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 1.9 p -140.62 144.15 35.59 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.293 0.568 . . . . 0.0 112.332 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.686 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 19.6 t -81.7 109.48 16.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.72 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.657 ' HE2' ' HA ' ' A' ' 467' ' ' LYS . 10.5 mmpt? -85.96 139.16 31.44 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.559 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.251 176.741 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.454 -0.27 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.3 tttm -61.43 105.24 0.49 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.592 173.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 136.74 -32.88 2.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.912 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 9.9 mmmm -65.76 142.45 57.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.273 . . . . 0.0 110.292 177.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.73 -176.85 22.46 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.141 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.53 -45.21 94.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.899 0.349 . . . . 0.0 111.19 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -71.29 -42.08 69.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 110.557 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.912 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.8 OUTLIER -65.03 -31.42 72.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.369 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.416 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 9.7 t -70.42 89.18 0.68 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.21 0.528 . . . . 0.0 109.736 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.418 ' HB3' ' HD2' ' A' ' 457' ' ' PRO . 97.2 mttt -83.97 147.4 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.189 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.476 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 15.4 m -60.77 -48.57 92.64 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 17.4 Cg_exo -64.66 -27.2 60.8 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.583 1.522 . . . . 0.0 111.487 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -82.47 -40.97 20.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.515 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.471 ' SG ' ' N ' ' A' ' 460' ' ' LYS . 22.1 t -162.99 -151.54 0.19 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.263 0.554 . . . . 0.0 111.103 -171.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.471 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 42.4 mmtm -147.2 127.67 14.07 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.577 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.416 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 67.0 t-105 -88.69 118.44 28.37 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -75.62 -72.21 0.33 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -178.2 41.09 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 155.32 -33.03 0.65 Allowed Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -176.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 28.0 m -132.46 136.89 47.01 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 120.874 0.369 . . . . 0.0 110.545 -179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 8.2 t -75.28 144.24 42.6 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -177.27 126.97 0.15 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.387 0.613 . . . . 0.0 111.229 -176.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.572 -178.321 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 454' ' ' CYS . 17.4 m . . . . . 0 N--CA 1.453 -0.321 0 CA-C-O 120.212 0.053 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -58.6 117.36 4.45 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 121.03 -28.99 5.91 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.969 -175.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -73.1 146.5 45.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.683 0.277 . . . . 0.0 111.339 -179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -81.76 173.72 53.81 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.59 173.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -63.6 -33.16 75.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -83.12 35.47 0.49 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.257 0.551 . . . . 0.0 111.269 177.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -160.08 -50.92 0.05 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.631 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.5 OUTLIER -72.46 120.6 18.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.027 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.495 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 16.4 ptpt -75.39 122.03 23.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.314 178.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . . . . . . . . . 21.1 m -69.57 -44.78 25.42 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -173.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.22 -40.61 81.38 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.179 1.253 . . . . 0.0 111.531 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.495 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 27.5 t70 -80.68 -43.46 20.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.753 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 88.3 m -121.6 133.88 55.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.164 0.507 . . . . 0.0 111.233 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.673 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 46.4 mttt -64.73 138.57 58.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.096 -176.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.45 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 61.3 t-105 -119.31 129.44 54.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.317 175.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -170.15 131.97 1.03 Allowed 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.214 0.321 . . . . 0.0 110.717 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 63.34 36.82 93.91 Favored Glycine 0 CA--C 1.517 0.192 0 CA-C-N 116.173 -0.467 . . . . 0.0 113.256 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.14 39.76 97.59 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.768 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.4 t -161.77 139.92 9.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.45 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 1.6 t -91.79 144.12 25.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.185 -176.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.673 ' HG2' ' HB2' ' A' ' 460' ' ' LYS . 0.0 OUTLIER -149.42 146.86 27.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.647 0.26 . . . . 0.0 110.811 -178.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 50.1 t0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.688 -0.672 . . . . 0.0 109.593 179.501 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.713 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 90.1 m . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -52.78 115.35 1.78 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.787 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 122.4 -28.48 5.76 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.587 -176.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.697 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 22.5 mtmm -80.41 138.26 36.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.578 0.227 . . . . 0.0 111.474 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -76.64 -169.79 30.69 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -62.67 -46.04 90.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.95 0.375 . . . . 0.0 111.539 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -64.3 -34.19 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 111.045 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.2 -40.32 27.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.876 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 14.7 t -58.65 114.09 2.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.958 -177.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.845 ' HE3' ' HA ' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -87.51 125.39 34.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.019 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.543 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 m -60.8 -49.03 91.24 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.6 Cg_endo -60.11 -26.74 83.3 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.022 1.815 . . . . 0.0 112.078 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -87.85 -45.34 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.924 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 68.9 m -146.27 152.65 39.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.271 0.558 . . . . 0.0 111.63 -176.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.1 131.84 35.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.3 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -78.71 113.55 16.87 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -74.58 -47.26 33.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.006 0.431 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.71 -46.47 0.18 Allowed Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.226 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -140.07 31.53 2.26 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 177.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.7 t -170.94 145.31 2.32 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.026 0.441 . . . . 0.0 110.242 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.713 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 12.3 t -87.7 132.23 34.19 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.42 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 0.0 OUTLIER -158.29 153.19 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.838 -171.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.887 179.455 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.513 ' SG ' ' HE2' ' A' ' 449' ' ' LYS . 3.6 t . . . . . 0 CA--C 1.534 0.338 0 CA-C-O 120.91 0.386 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 466' ' ' CYS . 55.0 tttm -59.37 128.82 39.01 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.361 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.05 -34.6 2.51 Favored Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -176.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.627 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 49.2 mtmt -76.63 139.86 40.76 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 177.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -66.95 174.51 25.44 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.85 -0.691 . . . . 0.0 111.45 176.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -58.01 -37.29 74.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.21 -43.48 74.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.383 . . . . 0.0 110.684 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.627 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 3.6 m-20 -72.07 -39.97 68.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.718 -179.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -73.97 71.22 1.55 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.92 176.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.77 ' HG3' ' HD2' ' A' ' 457' ' ' PRO . 20.7 tptm -64.29 135.06 55.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.53 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.551 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 37.2 m -53.72 -51.94 71.95 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -173.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.77 ' HD2' ' HG3' ' A' ' 455' ' ' LYS . 36.2 Cg_exo -61.18 -32.85 91.22 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 121.582 1.521 . . . . 0.0 111.553 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -77.58 -44.7 27.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.727 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 96.9 m -149.71 147.47 28.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 0.0 110.843 -175.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.722 ' HB2' ' HG3' ' A' ' 467' ' ' LYS . 49.4 mmtm -79.19 129.86 34.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.452 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -107.79 125.84 51.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.522 ' HB2' ' NZ ' ' A' ' 467' ' ' LYS . 12.7 tp10 -86.75 -131.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . 0.451 ' H ' ' HG3' ' A' ' 462' ' ' GLU . . . -82.3 -41.11 9.48 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.443 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -159.08 45.4 0.45 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.43 ' OG1' ' HE2' ' A' ' 447' ' ' LYS . 9.6 t -163.4 136.73 5.63 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.547 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 447' ' ' LYS . 11.2 t -90.01 145.86 24.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.959 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.722 ' HG3' ' HB2' ' A' ' 460' ' ' LYS . 9.4 ptpp? -144.88 160.48 41.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.666 0.269 . . . . 0.0 110.391 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.736 -0.65 . . . . 0.0 110.821 -176.977 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.674 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.0 m . . . . . 0 CA--C 1.533 0.291 0 CA-C-O 120.73 0.3 . . . . 0.0 111.332 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -53.52 133.01 41.1 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 68.01 33.76 80.01 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.115 -0.948 . . . . 0.0 114.529 171.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.674 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 46.8 mtmt -119.44 147.47 44.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.444 0.622 . . . . 0.0 110.626 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.36 155.48 53.05 Favored Glycine 0 C--O 1.225 -0.409 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.8 -33.99 67.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.297 0.548 . . . . 0.0 111.361 -177.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -57.02 -40.91 77.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.968 0.414 . . . . 0.0 110.535 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.555 ' OD2' ' HD2' ' A' ' 449' ' ' LYS . 33.5 t70 -91.57 -49.18 6.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.061 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.575 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.8 OUTLIER -73.21 92.88 1.79 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 111.832 -177.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -152.7 135.04 15.06 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.58 ' C ' ' H ' ' A' ' 458' ' ' ASP . 2.8 t -167.36 149.99 5.69 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.617 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -73.74 26.07 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.395 2.064 . . . . 0.0 109.798 172.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.58 ' H ' ' C ' ' A' ' 456' ' ' SER . 35.2 t70 -151.5 -43.23 0.11 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.569 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 456' ' ' SER . 73.8 m -71.75 138.87 48.77 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.393 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.409 ' HB3' ' NZ ' ' A' ' 460' ' ' LYS . 6.2 ttpm? -113.3 137.42 51.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.861 0.362 . . . . 0.0 110.719 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.759 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 58.7 t-105 -95.84 122.33 38.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.745 177.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.587 ' HG3' ' HE3' ' A' ' 467' ' ' LYS . 48.0 mm-40 -82.4 -38.43 24.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.186 0.517 . . . . 0.0 110.822 -178.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 155.49 -50.31 0.46 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -134.57 29.85 2.95 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 174.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.3 t -175.0 145.18 0.8 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.109 -0.545 . . . . 0.0 109.727 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.759 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 15.8 t -112.76 132.6 55.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.375 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.587 ' HE3' ' HG3' ' A' ' 462' ' ' GLU . 22.4 pttp -178.12 142.67 0.28 Allowed 'General case' 0 C--O 1.233 0.209 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 40.2 t0 . . . . . 0 C--O 1.253 1.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.914 175.94 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.584 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 85.2 m . . . . . 0 CA--C 1.514 -0.439 0 CA-C-O 121.754 0.788 . . . . 0.0 111.324 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -78.73 134.73 37.04 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.808 -177.225 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.7 32.82 35.98 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.509 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -113.51 143.12 45.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.45 163.76 52.91 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.604 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.63 -40.38 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.151 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 12.5 mptt -74.39 -34.6 63.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -71.61 -45.48 61.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 0.0 110.03 177.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.465 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.1 t -60.45 133.08 55.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.179 176.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 455' ' ' LYS . 30.7 mmtp -128.7 134.4 48.47 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.554 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 8.7 m -54.37 -50.74 83.3 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -173.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.554 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 31.9 Cg_exo -59.02 -28.22 87.25 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.824 1.683 . . . . 0.0 111.267 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -81.22 -54.58 5.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.548 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 95.1 m -155.8 158.88 38.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.101 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -89.37 137.67 32.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.939 0.4 . . . . 0.0 111.459 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.465 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 66.3 t-105 -89.25 117.99 28.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.66 174.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.51 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 6.0 mm-40 -119.05 116.62 26.78 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.958 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 66.15 -66.75 0.14 Allowed Glycine 0 C--N 1.333 0.385 0 O-C-N 123.807 0.692 . . . . 0.0 113.476 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -170.36 38.58 0.19 Allowed Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.403 HG23 ' HE3' ' A' ' 467' ' ' LYS . 14.5 t -159.8 139.98 11.79 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.584 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.7 t -94.82 139.03 31.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -174.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.51 ' HD3' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -155.55 151.87 28.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.34 . . . . 0.0 111.147 -177.568 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.781 -179.493 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.579 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 24.9 p . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.674 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 60.2 tttm -43.75 120.0 1.87 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.826 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.99 -32.83 5.31 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -61.58 152.81 29.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.009 0.433 . . . . 0.0 111.809 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.48 166.52 54.61 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.045 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -55.3 -50.76 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 26.5 tttm -63.85 -43.0 97.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.835 0.35 . . . . 0.0 110.801 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -67.19 -42.91 83.41 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.709 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.427 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 12.1 t -60.45 105.68 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.2 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 455' ' ' LYS . 38.7 mmtm -165.38 43.58 0.08 Allowed 'General case' 0 CA--C 1.498 -1.032 0 CA-C-O 121.854 0.835 . . . . 0.0 108.928 176.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.712 ' HB2' ' CB ' ' A' ' 459' ' ' CYS . 50.3 m -72.19 135.12 82.41 Favored Pre-proline 0 C--N 1.296 -1.737 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.935 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.75 24.44 0.29 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.559 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.685 ' H ' ' C ' ' A' ' 456' ' ' SER . 46.0 t0 -148.69 -27.86 0.3 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 112.818 -1.992 . . . . 0.0 108.84 -176.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.712 ' CB ' ' HB2' ' A' ' 456' ' ' SER . 13.7 t -88.49 -174.77 4.72 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.039 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.466 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 5.4 mmmm -158.41 135.02 9.55 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.356 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.427 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 56.3 t-105 -85.79 122.21 29.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -156.68 130.01 8.05 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.894 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.99 36.76 92.45 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.298 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.62 82.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.604 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -157.9 142.45 16.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.357 0.598 . . . . 0.0 110.945 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.674 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 5.5 t -79.32 142.1 36.4 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.1 pttp 178.07 137.87 0.08 Allowed 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.048 0.451 . . . . 0.0 111.217 -177.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 54.1 t0 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.506 -0.759 . . . . 0.0 109.446 174.926 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 79.3 m . . . . . 0 N--CA 1.453 -0.299 0 CA-C-O 120.935 0.397 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -58.9 126.46 27.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.427 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 120.44 -31.44 5.24 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.597 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -70.09 139.48 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.751 0.31 . . . . 0.0 111.329 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.37 165.34 54.32 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.42 -48.36 71.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.179 0.489 . . . . 0.0 111.692 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -67.56 -34.47 77.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.033 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -74.0 -44.32 54.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.853 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.0 t -54.99 119.26 5.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.124 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -90.38 123.64 34.28 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.492 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 28.2 t -57.19 -49.3 94.7 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 39.7 Cg_exo -60.57 -29.94 89.58 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 121.854 1.702 . . . . 0.0 111.786 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -82.32 -49.12 10.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.116 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 20.2 m -140.81 135.95 31.94 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -80.08 122.57 26.94 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.979 0.418 . . . . 0.0 110.484 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.482 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 68.6 t-105 -84.3 126.37 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.46 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 8.9 tt0 -156.97 133.3 9.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.604 0.24 . . . . 0.0 110.734 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.25 34.53 89.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.514 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.18 37.68 95.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.818 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 13.3 t -155.87 141.81 18.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.429 . . . . 0.0 110.314 177.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.482 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 30.9 t -89.05 126.52 35.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.812 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 63.5 pttt -144.25 139.85 28.9 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.805 0.336 . . . . 0.0 110.473 -178.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . 0.423 ' HB3' ' SG ' ' A' ' 446' ' ' CYS . 3.3 p30 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.636 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 58.1 m . . . . . 0 N--CA 1.442 -0.865 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -78.01 106.81 10.13 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.302 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 59.07 47.39 91.03 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.326 -0.852 . . . . 0.0 114.067 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.8 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 26.9 mtmt -107.55 -169.38 1.52 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.296 0.548 . . . . 0.0 110.25 174.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.44 154.1 36.08 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.29 -35.58 75.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.925 0.363 . . . . 0.0 110.453 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -57.77 -48.37 79.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.412 177.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.625 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.4 OUTLIER -68.92 -54.58 14.66 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.093 176.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.8 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 27.6 m -70.98 96.15 1.26 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.014 -0.994 . . . . 0.0 112.826 -174.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -145.9 142.51 28.83 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.561 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.569 ' C ' ' H ' ' A' ' 458' ' ' ASP . 3.3 t 174.71 149.26 0.25 Allowed Pre-proline 0 C--N 1.317 -0.814 0 O-C-N 124.138 0.899 . . . . 0.0 109.113 -178.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.76 27.88 0.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.268 1.979 . . . . 0.0 109.945 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.569 ' H ' ' C ' ' A' ' 456' ' ' SER . 11.6 t70 -150.58 -43.36 0.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.961 -177.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 456' ' ' SER . 62.1 m -68.56 134.32 49.84 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 174.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -125.34 149.76 47.81 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.848 -175.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.514 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 29.7 t-105 -101.49 131.03 47.84 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.667 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.591 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 40.0 tp10 -158.73 122.08 3.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.821 0.343 . . . . 0.0 110.905 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.37 41.55 98.07 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.52 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.1 41.85 99.67 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.12 -0.562 . . . . 0.0 112.764 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -169.97 147.86 3.36 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.06 0.457 . . . . 0.0 110.451 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.514 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.6 OUTLIER -95.27 145.42 25.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.255 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.591 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 62.3 pttt -157.25 149.05 22.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.049 0.452 . . . . 0.0 111.933 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 59.9 t0 . . . . . 0 C--O 1.248 1.009 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.103 174.723 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.495 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 67.5 m . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 121.252 0.549 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -71.32 118.33 13.99 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.535 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.76 23.97 61.12 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.499 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 23.1 ttmm -90.41 138.4 31.57 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -71.19 164.62 53.7 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.741 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.13 -37.91 78.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 117.013 0.406 . . . . 0.0 111.783 -177.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -74.66 -39.61 61.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.825 0.345 . . . . 0.0 110.599 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -70.05 -40.69 74.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.797 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.532 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.0 t -61.53 125.97 25.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.624 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.462 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 7.8 ptpp? -124.79 132.28 53.36 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.333 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.517 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.5 m -52.83 -47.95 93.05 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -59.51 -25.93 80.35 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.718 1.612 . . . . 0.0 111.94 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.462 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 26.0 t70 -92.99 -46.56 7.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.52 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.508 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 85.4 m -147.23 156.34 42.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 110.83 -178.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -90.03 120.27 31.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.64 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.532 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 70.6 t-105 -81.69 117.56 22.12 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -84.03 -37.65 21.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.02 0.438 . . . . 0.0 110.499 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 166.74 -46.03 0.26 Allowed Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.342 -0.703 . . . . 0.0 111.342 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -131.67 -10.3 2.36 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 11.2 m -130.26 136.03 48.74 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.967 0.413 . . . . 0.0 110.7 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 18.2 t -92.46 119.86 32.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.437 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.27 133.21 49.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.052 -175.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 35.2 t70 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.576 -0.726 . . . . 0.0 110.869 178.423 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.447 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 76.7 m . . . . . 0 N--CA 1.452 -0.346 0 CA-C-O 120.798 0.333 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -48.38 122.34 5.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.924 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 61.35 33.51 84.82 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.411 -0.813 . . . . 0.0 113.907 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.749 ' HD3' ' HA ' ' A' ' 454' ' ' CYS . 18.2 ptmt -85.31 -19.94 30.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.174 0.487 . . . . 0.0 110.954 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 103.65 150.78 21.88 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.806 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . 0.414 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 29.1 tt0 -63.37 -43.1 98.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 122.455 0.302 . . . . 0.0 111.44 -175.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.52 42.04 0.81 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.365 0.603 . . . . 0.0 110.563 177.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -160.62 -38.14 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.445 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 449' ' ' LYS . 19.9 t -74.49 73.98 1.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.09 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.5 132.83 47.65 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.3 m -50.19 -50.31 70.77 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -171.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 456' ' ' SER . 20.2 Cg_endo -61.6 -31.61 87.07 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.839 1.693 . . . . 0.0 111.688 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -83.29 -44.1 15.29 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.4 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.21 146.3 26.75 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -86.26 128.34 34.9 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.706 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.617 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 64.8 t-105 -96.13 111.15 23.27 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 174.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -82.88 47.11 1.16 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.978 0.418 . . . . 0.0 110.971 -176.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 57.95 38.13 87.78 Favored Glycine 0 C--N 1.33 0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.688 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 152.47 -37.48 0.79 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.179 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 24.4 m -123.16 129.16 51.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.201 . . . . 0.0 111.218 -177.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.617 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 23.2 t -82.01 138.06 34.97 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.33 141.43 32.36 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.01 0.433 . . . . 0.0 110.754 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.994 -178.467 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.9 m . . . . . 0 N--CA 1.449 -0.525 0 CA-C-O 120.731 0.3 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 81.1 tttt 33.07 75.67 0.05 OUTLIER 'General case' 0 C--O 1.235 0.294 0 N-CA-C 114.379 1.252 . . . . 0.0 114.379 176.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . 0.702 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . 48.66 35.1 15.93 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 114.562 -1.199 . . . . 0.0 115.37 169.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.7 ' HG3' ' HB2' ' A' ' 454' ' ' CYS . 0.3 OUTLIER -85.81 149.45 25.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.921 0.86 . . . . 0.0 108.84 173.111 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -56.04 150.97 22.61 Favored Glycine 0 C--O 1.227 -0.318 0 C-N-CA 121.444 -0.408 . . . . 0.0 113.384 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.6 -33.48 66.27 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.79 -176.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 452' ' ' LYS . 27.3 mmtp -61.66 -37.93 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.87 0.367 . . . . 0.0 110.204 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -81.06 -48.04 12.74 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.781 175.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.7 ' HB2' ' HG3' ' A' ' 449' ' ' LYS . 0.5 OUTLIER -84.58 116.71 23.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.519 -173.715 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -89.43 139.81 30.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.837 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.538 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 10.5 t -58.78 -48.79 96.17 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.994 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.3 Cg_endo -58.51 -29.85 89.99 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.853 1.702 . . . . 0.0 112.007 178.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -84.05 -42.32 16.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 67.7 m -141.58 149.82 41.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.372 -173.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -79.37 135.69 36.78 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.998 0.428 . . . . 0.0 110.532 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 52.3 t-105 -106.28 132.35 52.44 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.855 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.422 ' OE2' ' HD2' ' A' ' 467' ' ' LYS . 30.2 mt-10 -129.64 79.94 1.93 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.856 0.36 . . . . 0.0 111.402 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.29 -63.11 2.96 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.363 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.1 36.49 0.53 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.833 -0.698 . . . . 0.0 111.786 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.0 t -157.87 141.94 15.91 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.702 ' H ' ' HA2' ' A' ' 448' ' ' GLY . 0.5 OUTLIER -104.7 145.93 29.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.879 -178.22 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.422 ' HD2' ' OE2' ' A' ' 462' ' ' GLU . 18.5 ptpt -163.52 159.46 22.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.987 0.422 . . . . 0.0 111.764 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.2 t0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.967 176.427 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.404 ' HB2' ' HA ' ' A' ' 467' ' ' LYS . 83.5 m . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 120.735 0.303 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -64.74 117.73 7.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 139.25 -35.97 1.91 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -175.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.78 137.75 54.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.131 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.76 -169.99 41.94 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 169.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -67.11 -34.89 78.58 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 117.108 0.454 . . . . 0.0 111.234 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.67 -38.92 53.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.118 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.44 -49.07 67.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.511 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 4.7 t -62.4 123.46 18.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.347 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 51.5 mttm -141.91 33.28 1.58 Allowed 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 122.023 0.916 . . . . 0.0 110.114 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.664 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 39.0 m 45.67 50.12 7.41 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 113.059 -1.882 . . . . 0.0 113.136 178.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' A' ' 456' ' ' SER . 5.2 Cg_exo -74.33 -44.75 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.902 1.735 . . . . 0.0 109.88 175.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.01 36.81 0.15 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 173.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 456' ' ' SER . 57.4 m -147.89 145.42 28.65 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.756 -171.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -114.41 136.47 52.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.747 0.308 . . . . 0.0 110.616 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 58.8 t-105 -80.94 118.63 22.59 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.791 ' HB3' ' HD2' ' A' ' 467' ' ' LYS . 34.2 tt0 -155.06 133.09 11.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.657 0.265 . . . . 0.0 110.724 -175.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.39 35.94 81.5 Favored Glycine 0 C--O 1.234 0.122 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.794 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 62.17 40.1 98.52 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.514 HG22 ' HG3' ' A' ' 467' ' ' LYS . 5.3 m -157.76 133.77 9.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.804 0.335 . . . . 0.0 110.529 -175.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . . . . . . . . . 11.9 t -86.62 119.41 26.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.791 ' HD2' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -157.85 155.12 29.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.752 -173.291 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.267 -0.873 . . . . 0.0 111.197 -176.493 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 65.1 m . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 120.592 0.234 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -62.64 120.83 11.94 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.277 -177.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 115.31 -17.43 16.67 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.292 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.636 ' HB3' ' HB3' ' A' ' 453' ' ' ASP . 42.6 mtmt -81.74 142.3 32.77 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.857 0.328 . . . . 0.0 110.825 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.61 167.15 50.74 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -56.95 -38.55 73.09 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -69.54 -31.09 69.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.774 0.321 . . . . 0.0 111.263 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.636 ' HB3' ' HB3' ' A' ' 449' ' ' LYS . 2.3 t0 -81.57 -38.67 25.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.0 109.519 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -60.61 145.73 47.89 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.559 174.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.484 ' HD2' ' O ' ' A' ' 453' ' ' ASP . 7.8 mptt -137.29 148.78 46.63 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.508 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 3.5 m -63.41 -47.51 83.73 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 456' ' ' SER . 37.7 Cg_endo -65.25 -29.38 55.2 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 121.029 1.152 . . . . 0.0 110.965 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.54 -48.36 22.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.41 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 36.4 m -158.06 -162.17 1.11 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.175 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -121.65 136.92 54.93 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.313 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.461 ' CE3' ' HB2' ' A' ' 466' ' ' CYS . 71.9 t-105 -103.18 124.75 49.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.6 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -135.5 110.88 9.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.761 0.315 . . . . 0.0 110.781 -178.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 70.09 -67.02 0.68 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.668 -0.696 . . . . 0.0 113.034 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -169.44 43.08 0.21 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -157.78 138.22 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.938 0.399 . . . . 0.0 110.032 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.461 ' HB2' ' CE3' ' A' ' 461' ' ' TRP . 14.7 t -106.86 130.51 54.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.212 -176.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -161.49 150.68 16.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.168 0.508 . . . . 0.0 112.025 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 37.3 t0 . . . . . 0 C--O 1.245 0.859 0 CA-C-O 118.07 -0.967 . . . . 0.0 109.382 179.595 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.629 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 36.4 m . . . . . 0 N--CA 1.449 -0.49 0 CA-C-O 120.694 0.283 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -73.29 132.24 42.87 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.314 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 70.49 34.42 67.95 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.898 -0.592 . . . . 0.0 113.758 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -88.39 -49.6 6.84 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.332 -0.511 . . . . 0.0 110.731 176.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 105.21 150.84 20.14 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -171.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.01 -41.78 92.88 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.108 0.454 . . . . 0.0 112.104 -171.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -68.06 -38.89 82.96 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.706 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.75 -43.41 65.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.946 0.403 . . . . 0.0 110.415 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 34.2 t -54.76 120.27 6.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.171 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 12.0 tptt -89.28 123.03 33.11 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.483 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.0 m -58.92 -50.87 85.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -174.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 456' ' ' SER . 25.2 Cg_endo -61.37 -30.88 88.12 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 121.61 1.54 . . . . 0.0 111.811 178.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.73 -46.18 22.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.371 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 468' ' ' ASP . 66.3 m -148.15 143.23 26.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.102 0.477 . . . . 0.0 110.808 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -79.32 159.16 27.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.69 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.644 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 39.2 t-105 -102.09 124.12 47.14 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.247 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -106.71 59.61 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.359 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.49 -55.04 4.08 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.604 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.8 31.41 0.61 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.308 -0.717 . . . . 0.0 111.308 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 40.2 m -143.17 129.09 19.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.507 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.644 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 46.9 t -91.81 117.08 29.44 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.08 134.61 1.6 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . 0.569 ' HB2' ' HA ' ' A' ' 459' ' ' CYS . 32.0 t70 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.362 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.46 ' SG ' ' HD3' ' A' ' 449' ' ' LYS . 11.8 t . . . . . 0 CA--C 1.52 -0.209 0 CA-C-O 122.09 0.948 . . . . 0.0 109.36 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 89.2 tttt -70.6 126.23 29.04 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.146 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 131.97 -30.56 3.19 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.193 -178.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.46 ' HD3' ' SG ' ' A' ' 446' ' ' CYS . 30.9 mtpp -76.07 137.47 40.2 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.257 0.551 . . . . 0.0 111.123 -177.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -78.48 162.25 49.14 Favored Glycine 0 C--O 1.22 -0.728 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.372 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.86 -35.32 76.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.718 0.759 . . . . 0.0 110.648 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -84.16 40.52 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.305 0.574 . . . . 0.0 110.316 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -164.09 -50.39 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.867 -177.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.86 132.83 40.59 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 21.5 tptm -144.61 45.95 1.38 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.789 0.804 . . . . 0.0 110.779 -171.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.668 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 20.3 m 44.25 44.47 1.55 Allowed Pre-proline 0 C--N 1.314 -0.95 0 CA-C-N 114.084 -1.416 . . . . 0.0 114.266 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.596 ' HD3' ' N ' ' A' ' 456' ' ' SER . 4.5 Cg_endo -82.05 -48.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.921 1.747 . . . . 0.0 110.326 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.425 ' H ' ' HD2' ' A' ' 457' ' ' PRO . 8.5 t70 -148.25 37.9 0.86 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 173.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.668 ' O ' ' HA ' ' A' ' 456' ' ' SER . 4.0 m -148.64 132.66 17.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.85 -172.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.33 136.58 45.81 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.189 177.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.458 ' HE3' ' SG ' ' A' ' 466' ' ' CYS . 32.2 t-105 -85.93 126.45 34.11 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.031 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.59 121.33 9.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.761 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 55.53 45.75 83.34 Favored Glycine 0 N--CA 1.453 -0.191 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.999 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.78 35.94 92.0 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.589 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 60.9 m -155.17 134.22 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.552 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -85.52 130.63 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.018 178.686 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -168.28 133.8 1.82 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 60.4 t0 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.964 -0.541 . . . . 0.0 109.773 -179.726 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.685 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 34.3 m . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 120.714 0.292 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 83.1 tttt -56.51 133.33 53.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.628 -177.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 102.18 -28.59 15.25 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.746 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -65.1 144.15 57.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.004 0.43 . . . . 0.0 111.71 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 162.61 54.72 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.457 178.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -59.78 -42.92 94.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.299 0.549 . . . . 0.0 111.051 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -65.83 -36.39 83.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.782 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -75.15 -45.62 39.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.743 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 51.0 t -56.68 119.07 5.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.282 -178.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -81.04 109.44 15.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.526 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.6 m -59.97 -48.66 94.16 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -171.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.0 Cg_endo -58.28 -38.74 89.53 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 121.175 1.25 . . . . 0.0 111.356 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -77.16 -47.99 18.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.4 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.62 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 16.5 m -127.06 132.6 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -79.99 130.82 35.57 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.941 0.401 . . . . 0.0 110.913 -176.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -82.3 122.46 27.98 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -166.44 137.65 3.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.718 0.294 . . . . 0.0 110.485 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 69.77 37.03 75.61 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.453 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 58.12 34.6 73.74 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.393 -0.432 . . . . 0.0 112.773 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 6.1 t -167.68 157.6 10.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.014 0.435 . . . . 0.0 110.119 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.685 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 14.4 t -82.36 120.8 25.89 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.469 -176.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 459' ' ' CYS . 74.1 mmtt -90.73 146.51 23.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.751 0.31 . . . . 0.0 111.066 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 40.3 t0 . . . . . 0 C--O 1.246 0.92 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.271 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 73.0 m . . . . . 0 N--CA 1.454 -0.236 0 CA-C-O 120.997 0.427 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.2 tptt -60.33 113.66 2.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.727 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 127.01 -25.56 5.22 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.602 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.516 ' HE3' ' OD2' ' A' ' 453' ' ' ASP . 55.3 mtpt -75.45 141.28 43.17 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 120.933 0.397 . . . . 0.0 111.032 -177.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.31 158.2 50.45 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.961 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . 0.538 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 38.9 tt0 -60.25 -36.9 78.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.962 0.381 . . . . 0.0 111.346 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -83.8 37.83 0.61 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.223 0.535 . . . . 0.0 110.844 178.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.516 ' OD2' ' HE3' ' A' ' 449' ' ' LYS . 29.4 t70 -163.52 -50.13 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.909 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 1.7 t -68.12 125.67 27.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.461 176.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 41.6 mmtm -92.26 135.64 33.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -178.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.502 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 23.1 t -60.56 -50.0 87.47 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.502 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 26.7 Cg_exo -62.42 -29.12 78.79 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.632 1.554 . . . . 0.0 111.504 178.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.458 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 38.0 t70 -80.8 -42.32 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.241 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.84 134.47 24.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -66.23 115.87 6.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.941 0.401 . . . . 0.0 111.23 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.538 ' CZ2' ' HB2' ' A' ' 451' ' ' GLU . 48.9 t-105 -85.44 119.38 25.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 172.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -154.58 126.03 7.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.695 0.283 . . . . 0.0 110.734 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.58 33.08 75.74 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.082 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.43 39.21 97.48 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 121.188 -0.53 . . . . 0.0 112.37 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.8 t -165.9 145.16 6.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.1 OUTLIER -86.21 135.51 33.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 -175.571 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -130.88 139.72 50.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.009 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 33.4 t70 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.785 -0.626 . . . . 0.0 109.991 178.778 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.558 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 46.0 m . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 120.718 0.294 . . . . 0.0 110.753 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -62.46 133.5 55.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.372 -175.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.93 53.87 6.08 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.288 176.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.822 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 49.9 mtpt -122.17 -50.71 2.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.994 0.426 . . . . 0.0 111.44 178.238 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 126.53 156.01 9.08 Favored Glycine 0 N--CA 1.444 -0.803 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -172.003 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -61.84 -41.97 98.46 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.323 0.562 . . . . 0.0 111.392 -173.369 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.6 pttm -71.95 -34.78 69.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.624 179.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.822 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -75.51 -40.19 57.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.388 -179.033 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.8 t -59.9 118.62 6.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.176 179.025 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -74.72 123.25 24.58 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.235 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.457 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 46.0 m -71.13 -51.57 10.28 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -173.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 456' ' ' SER . 28.6 Cg_endo -63.61 -27.33 69.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.512 1.475 . . . . 0.0 111.871 -179.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -97.39 -33.17 11.51 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.479 -174.278 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.2 m -129.98 150.27 51.34 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 122.127 -0.358 . . . . 0.0 110.974 -172.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.479 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 63.5 mttm -86.87 139.11 30.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.33 -179.119 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.476 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.2 t-105 -111.78 122.74 48.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.523 ' HB3' ' HE3' ' A' ' 467' ' ' LYS . 69.4 tt0 -158.58 134.54 9.04 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.513 0.196 . . . . 0.0 110.866 -175.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.35 31.63 81.05 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.354 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.53 37.83 94.94 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.171 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.8 t -165.35 146.91 7.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.097 0.475 . . . . 0.0 110.711 179.398 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.7 t -87.11 147.49 25.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.094 -175.22 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.523 ' HE3' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.71 142.72 27.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.973 0.416 . . . . 0.0 110.456 178.565 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 C--O 1.254 1.317 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.356 -179.128 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.499 ' HA ' ' HB2' ' A' ' 466' ' ' CYS . 26.5 ttpp -58.62 125.2 22.44 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.349 -175.048 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.1 -20.52 4.49 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.255 -176.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.874 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 29.7 mtpt -93.45 -152.74 0.34 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.224 -178.113 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -127.83 160.94 21.82 Favored Glycine 0 C--O 1.219 -0.794 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.654 177.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -42.6 -43.08 3.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -174.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -64.0 -42.9 97.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.232 -178.66 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.755 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 46.6 m-20 -73.11 -51.08 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.658 0.742 . . . . 0.0 109.6 175.247 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.874 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 77.5 m -72.6 53.83 0.32 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 124.907 1.283 . . . . 0.0 111.472 177.391 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.656 ' HE2' ' HG2' ' A' ' 457' ' ' PRO . 20.6 ptmt -63.12 141.95 58.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.556 -177.357 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.519 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 7.3 t -50.4 -48.54 80.85 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.568 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.656 ' HG2' ' HE2' ' A' ' 455' ' ' LYS . 13.5 Cg_endo -57.63 -37.38 97.09 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 121.769 1.646 . . . . 0.0 112.621 -179.367 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -85.42 -36.82 20.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 456' ' ' SER . 82.0 m -138.54 135.54 35.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.006 -173.026 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.71 ' HB3' ' HB2' ' A' ' 467' ' ' LYS . 83.1 tttt -72.19 143.79 48.76 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 175.076 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.677 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 44.2 t-105 -116.49 126.68 53.7 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.08 -176.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.693 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 41.9 tt0 -95.99 -65.64 0.96 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 0.0 110.896 -179.11 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -179.24 87.34 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 68.56 31.65 73.94 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.744 -175.861 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.4 t -166.2 130.17 2.13 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -179.599 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.677 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 1.7 m -77.99 140.73 39.21 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.098 -177.233 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.71 ' HB2' ' HB3' ' A' ' 460' ' ' LYS . 27.1 mmmt -93.72 171.32 8.96 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.465 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 31.4 t70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.802 -169.6 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.841 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 21.4 m . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.641 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 64.2 tttp -54.57 110.57 0.65 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.754 -176.189 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 112.55 -19.35 21.85 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.747 -0.74 . . . . 0.0 113.096 -178.533 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.834 ' HE3' ' HB3' ' A' ' 453' ' ' ASP . 31.1 mmmt -68.86 142.8 54.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 117.01 0.405 . . . . 0.0 111.335 -178.152 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -68.2 163.32 48.5 Favored Glycine 0 C--O 1.224 -0.502 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 175.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -55.01 -45.09 75.06 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -175.458 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -65.37 -44.84 86.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.898 0.38 . . . . 0.0 110.595 -179.008 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.834 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -67.13 -44.75 79.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.157 179.226 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 33.4 t -64.88 122.12 16.22 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.49 -175.441 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 68.4 mttm -76.27 122.53 24.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.701 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.503 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 19.4 m -68.39 -50.31 28.4 Favored Pre-proline 0 C--N 1.322 -0.589 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -174.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 21.3 Cg_exo -65.01 -37.58 32.61 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 121.247 1.298 . . . . 0.0 110.974 179.076 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 7.7 t70 -71.28 -39.54 71.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.368 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 54.6 m -138.65 140.34 38.83 Favored 'General case' 0 N--CA 1.458 -0.053 0 CA-C-O 121.24 0.543 . . . . 0.0 112.091 -174.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 467' ' ' LYS . 62.0 tttp -71.17 135.62 47.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.739 -178.17 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.625 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.4 t-105 -100.77 107.89 19.57 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 174.354 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.493 ' HB2' ' CD ' ' A' ' 467' ' ' LYS . 22.8 tt0 -82.7 50.8 1.75 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.019 0.437 . . . . 0.0 110.875 -177.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 54.61 31.68 53.0 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.699 -0.682 . . . . 0.0 113.755 177.931 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 161.45 -40.57 0.4 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.8 179.064 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.7 t -115.37 134.56 54.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.247 0.546 . . . . 0.0 110.812 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.841 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 47.4 t -81.95 140.24 34.13 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.633 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.493 ' CD ' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.34 147.21 30.1 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.417 0.627 . . . . 0.0 111.192 -174.352 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 . . . . . 0 C--N 1.316 -0.88 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.94 -179.473 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.621 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 75.0 m . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 40.8 ttmt -57.67 117.92 4.72 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.011 -176.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 56.35 46.32 87.11 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.308 -0.86 . . . . 0.0 113.822 173.842 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.594 ' HD2' ' HA ' ' A' ' 454' ' ' CYS . 12.4 ptpt -90.89 -41.37 11.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 117.203 0.501 . . . . 0.0 111.849 -179.65 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 123.91 151.68 8.24 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.999 -178.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 453' ' ' ASP . 6.4 tm-20 -66.28 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.563 0.181 . . . . 0.0 111.033 -176.049 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -79.15 38.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.175 0.512 . . . . 0.0 110.52 177.676 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 451' ' ' GLU . 50.6 t0 -166.22 -43.85 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.496 -178.93 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.594 ' HA ' ' HD2' ' A' ' 449' ' ' LYS . 53.7 t -64.16 112.15 2.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.242 -176.072 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.435 ' O ' ' HD3' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -170.65 138.24 1.42 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.432 168.911 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 458' ' ' ASP . 12.2 t 170.04 142.15 0.08 OUTLIER Pre-proline 0 C--N 1.315 -0.928 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.2 -176.254 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.77 8.27 1.04 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 121.603 1.535 . . . . 0.0 110.008 172.753 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.495 ' H ' ' C ' ' A' ' 456' ' ' SER . 87.8 m-20 -115.17 -52.17 2.69 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.992 177.972 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 63.8 m -82.44 131.59 35.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.691 179.74 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.48 141.71 44.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.256 -178.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -85.87 123.51 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.699 176.218 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -103.87 55.83 0.73 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.855 0.36 . . . . 0.0 110.711 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.62 -52.16 3.11 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.199 -0.524 . . . . 0.0 113.359 179.166 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -152.2 33.88 0.85 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.09 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.5 t -171.4 134.08 0.86 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.621 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.8 t -91.98 140.66 29.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.286 -0.416 . . . . 0.0 109.911 -176.848 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -168.21 136.56 2.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.159 0.504 . . . . 0.0 111.414 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 56.8 t0 . . . . . 0 C--O 1.248 1.014 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.323 175.674 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 6.4 t . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -63.37 132.12 50.48 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.436 -175.111 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 138.56 -39.26 1.59 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.87 143.64 56.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.388 -0.406 . . . . 0.0 110.751 179.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.73 166.0 49.74 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 175.2 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . 0.6 ' HG2' ' H ' ' A' ' 452' ' ' LYS . 12.3 pm0 -55.07 -56.76 16.22 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . 0.6 ' H ' ' HG2' ' A' ' 451' ' ' GLU . 1.3 mptm? -71.23 -37.11 72.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.853 0.358 . . . . 0.0 110.638 177.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -63.6 -34.06 76.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.86 -178.152 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.0 115.64 3.0 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.248 176.166 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -84.48 128.23 34.47 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -177.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.611 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 1.9 m -60.27 -54.53 54.24 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -171.909 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 46.6 Cg_exo -57.77 -33.31 96.68 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.733 1.622 . . . . 0.0 111.538 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -77.08 -49.16 15.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.439 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 25.2 m -151.69 136.36 17.07 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.411 -174.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -86.16 141.05 29.64 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.102 -0.374 . . . . 0.0 110.175 176.531 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -87.43 118.23 26.75 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.265 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.517 ' HB2' ' HE3' ' A' ' 467' ' ' LYS . 81.3 mt-10 -149.63 132.29 15.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.721 0.296 . . . . 0.0 110.998 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 59.17 38.01 92.53 Favored Glycine 0 N--CA 1.452 -0.245 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.517 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.81 38.54 96.12 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.145 -178.561 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 88.4 m -150.94 128.43 11.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.883 0.373 . . . . 0.0 110.945 -176.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 5.9 t -78.06 126.7 31.2 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.951 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.517 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 22.0 pttp -166.4 149.37 7.03 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.712 -175.549 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.9 t70 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.258 -0.877 . . . . 0.0 109.434 174.753 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.525 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 12.6 t . . . . . 0 N--CA 1.454 -0.251 0 CA-C-O 120.575 0.226 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 17.9 tttp -54.59 124.69 17.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.057 0.455 . . . . 0.0 111.089 -176.029 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 83.07 26.99 42.31 Favored Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.51 -0.768 . . . . 0.0 114.647 173.277 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.894 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 42.6 mtpt -84.05 -25.78 29.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.049 0.925 . . . . 0.0 109.226 170.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 96.19 141.14 11.65 Favored Glycine 0 C--O 1.215 -1.071 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.619 -177.825 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -45.34 -43.74 11.1 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -171.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -57.89 -43.69 86.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.062 0.458 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.72 ' OD2' ' HE2' ' A' ' 449' ' ' LYS . 23.6 t0 -81.5 -45.3 16.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.332 179.524 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.894 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 70.9 m -71.64 64.58 0.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.892 1.277 . . . . 0.0 111.331 174.986 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -65.72 145.4 56.06 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.817 -178.102 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.0 m -56.2 -48.37 97.01 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -175.77 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.3 Cg_endo -62.31 -33.05 81.6 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 121.491 1.461 . . . . 0.0 111.712 177.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -79.96 -40.97 26.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.145 -178.469 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 97.9 m -146.14 142.24 28.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.512 -176.308 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -75.2 125.21 28.49 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.851 0.358 . . . . 0.0 110.791 179.367 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.705 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 26.9 t-105 -96.44 115.93 28.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.696 178.966 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -89.07 -47.37 8.15 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.922 0.391 . . . . 0.0 110.907 -178.381 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.76 65.85 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 82.69 37.94 12.85 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.513 -174.137 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -167.56 136.7 2.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.739 0.304 . . . . 0.0 110.393 178.569 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.705 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.0 OUTLIER -102.15 138.9 38.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.194 -176.405 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -172.93 -173.29 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.919 0.39 . . . . 0.0 110.614 176.796 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 31.7 t70 . . . . . 0 C--O 1.248 1.002 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.33 176.404 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.471 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 57.6 m . . . . . 0 N--CA 1.451 -0.376 0 CA-C-O 120.747 0.308 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -64.74 128.38 35.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.113 0.482 . . . . 0.0 110.999 -175.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.78 22.2 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.496 -0.774 . . . . 0.0 113.25 177.436 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 446' ' ' CYS . 43.4 mtpt -99.04 -48.82 4.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.128 0.489 . . . . 0.0 110.406 174.127 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 102.75 153.61 24.6 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -175.93 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.04 -39.92 83.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.88 0.34 . . . . 0.0 111.434 -177.499 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -86.57 37.6 0.75 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.249 0.547 . . . . 0.0 111.08 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -157.06 -45.93 0.07 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.333 -0.848 . . . . 0.0 108.889 177.513 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.1 t -63.22 115.91 4.96 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.199 175.003 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.477 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 94.8 mttt -101.74 141.06 35.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.573 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.487 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 22.1 m -56.13 -50.47 87.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.282 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 456' ' ' SER . 32.8 Cg_endo -63.33 -31.64 73.11 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.535 1.49 . . . . 0.0 110.942 177.339 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.477 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 14.6 t70 -71.32 -52.38 19.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.715 179.56 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.493 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 70.8 m -156.65 147.52 21.86 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -178.8 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -81.1 122.87 27.88 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.817 -176.345 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -87.56 106.64 18.14 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 174.383 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -146.62 130.31 16.99 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -174.664 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.18 32.42 84.12 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.788 -175.016 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.48 24.01 69.02 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.282 -177.479 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 57.0 m -132.18 133.75 44.57 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 120.797 0.332 . . . . 0.0 110.459 -177.65 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 31.2 t -88.96 118.77 28.93 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.343 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -161.72 144.61 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -174.587 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' A' ' 459' ' ' CYS . 9.8 t70 . . . . . 0 C--O 1.245 0.844 0 O-C-N 124.311 1.007 . . . . 0.0 110.972 -179.26 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.559 ' O ' ' HE2' ' A' ' 449' ' ' LYS . 57.9 m . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.706 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 63.5 tttp 59.08 144.97 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.887 0.875 . . . . 0.0 112.844 176.706 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . 0.553 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . -73.14 51.86 1.7 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.857 179.311 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.559 ' HE2' ' O ' ' A' ' 446' ' ' CYS . 33.6 mtmt -74.48 -152.21 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 179.773 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -83.26 156.23 33.59 Favored Glycine 0 N--CA 1.443 -0.88 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 174.234 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -41.07 98.53 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.685 0.279 . . . . 0.0 111.301 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -69.05 -34.05 74.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.835 0.35 . . . . 0.0 110.51 179.942 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.33 -51.83 27.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.663 176.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 16.0 t -53.67 129.84 34.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.032 174.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.97 116.81 23.58 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 173.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.571 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 25.0 m -65.93 -47.04 64.92 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.413 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.1 Cg_endo -57.98 -38.44 92.05 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.667 1.578 . . . . 0.0 111.645 177.591 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -76.76 -48.22 19.34 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.175 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 60.6 m -130.4 142.54 50.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 111.189 -175.178 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -76.95 133.98 39.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.072 0.463 . . . . 0.0 110.99 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -102.98 119.84 39.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.479 176.512 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -159.94 143.68 14.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.686 0.279 . . . . 0.0 110.674 178.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.17 32.1 79.33 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.285 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.13 41.82 99.63 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.975 179.375 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.7 t -160.4 146.89 15.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.012 0.434 . . . . 0.0 110.496 178.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.706 ' HB3' ' O ' ' A' ' 447' ' ' LYS . 20.6 t -97.48 121.25 39.16 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.711 -176.748 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -133.56 141.85 47.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.792 0.33 . . . . 0.0 111.576 -175.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.519 -0.753 . . . . 0.0 109.718 175.036 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.48 ' SG ' ' HD2' ' A' ' 449' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -55.1 113.0 1.19 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.909 0.385 . . . . 0.0 110.982 -174.713 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.83 -30.86 3.03 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.295 -174.51 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.48 ' HD2' ' SG ' ' A' ' 446' ' ' CYS . 96.0 mttt -63.93 140.41 58.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.733 -0.233 . . . . 0.0 110.996 178.429 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.52 172.67 47.89 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 171.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.82 -41.73 78.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.277 0.539 . . . . 0.0 111.101 -178.594 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -71.57 -41.75 68.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.487 -178.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.62 -35.57 80.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.293 0.568 . . . . 0.0 110.451 177.008 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 15.9 t -68.37 109.16 3.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.522 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -85.18 126.92 34.04 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.528 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -59.4 -49.58 91.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -175.725 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.4 Cg_endo -61.0 -33.21 92.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.716 1.611 . . . . 0.0 111.67 178.659 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -78.04 -45.39 23.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.505 -179.681 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 57.6 m -146.87 143.14 28.34 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 -178.901 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 467' ' ' LYS . 16.4 ptpt -86.41 135.54 33.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.205 0.526 . . . . 0.0 110.798 178.237 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.403 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 77.2 t-105 -95.28 121.14 36.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.52 -175.859 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -81.52 -135.72 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.485 178.56 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.81 -43.1 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.317 177.1 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.28 44.68 0.55 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.549 -0.621 . . . . 0.0 111.549 179.542 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.6 t -162.29 136.19 6.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.368 0.604 . . . . 0.0 110.554 178.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 35.5 t -96.29 134.9 38.84 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.47 -0.786 . . . . 0.0 108.943 178.415 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.497 ' HD3' ' O ' ' A' ' 460' ' ' LYS . 0.0 OUTLIER -153.0 135.07 14.8 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.911 -0.716 . . . . 0.0 111.715 -178.113 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 23.2 t70 . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.486 -179.807 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 2.4 t . . . . . 0 N--CA 1.463 0.182 0 CA-C-O 121.354 0.597 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 62.0 tttp -75.76 128.17 34.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.176 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 133.22 -37.93 1.93 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.281 179.3 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.271 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.33 179.42 25.08 Favored Glycine 0 C--O 1.226 -0.359 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.7 175.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.98 -43.75 94.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.219 0.51 . . . . 0.0 111.558 -176.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.93 -40.47 91.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.044 0.45 . . . . 0.0 110.354 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -69.95 -41.01 75.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.912 -179.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.5 114.12 2.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.098 -177.355 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 49.8 mtmt -72.6 117.23 14.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 176.048 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.507 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.7 t -64.59 -50.35 65.68 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -173.883 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 456' ' ' SER . 29.6 Cg_endo -61.47 -29.81 85.68 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.632 1.555 . . . . 0.0 111.649 178.514 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.562 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 1.0 OUTLIER -85.35 -40.91 15.97 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.221 -176.032 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.5 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 9.2 m -137.88 144.66 41.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.678 0.275 . . . . 0.0 110.452 -174.629 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 460' ' ' LYS . 4.4 mptp? -80.9 148.02 30.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.089 0.471 . . . . 0.0 110.532 178.67 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -107.43 123.02 47.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.454 178.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.515 ' HG2' ' H ' ' A' ' 463' ' ' GLY . 22.9 tt0 -85.33 -136.67 0.06 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 177.268 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . 0.515 ' H ' ' HG2' ' A' ' 462' ' ' GLU . . . -73.88 -42.76 36.93 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 110.904 -0.879 . . . . 0.0 110.904 175.132 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.99 42.59 0.48 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 177.456 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 91.2 m -148.47 129.19 14.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.811 0.339 . . . . 0.0 110.943 -176.96 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.547 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 8.7 t -83.6 135.79 34.48 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.139 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -159.78 134.89 8.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.467 0.651 . . . . 0.0 111.887 -179.659 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.684 178.12 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.578 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 63.8 m . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 120.695 0.283 . . . . 0.0 110.592 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -71.85 125.67 27.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 110.595 -177.004 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 130.08 -29.57 3.68 Favored Glycine 0 N--CA 1.441 -0.971 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.315 -178.803 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.544 ' HB2' ' CB ' ' A' ' 453' ' ' ASP . 9.8 pttm -97.45 139.11 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.638 178.942 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.22 -168.88 14.54 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.418 -174.76 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.32 -40.87 90.2 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 122.658 0.383 . . . . 0.0 111.484 -176.785 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -62.5 -41.52 98.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.154 0.502 . . . . 0.0 110.119 178.071 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.544 ' CB ' ' HB2' ' A' ' 449' ' ' LYS . 90.6 m-20 -73.73 -41.61 62.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.528 -179.411 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 7.8 t -63.41 118.76 8.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.84 -176.038 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -156.65 172.97 17.64 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.545 -178.779 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.434 ' OG ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 t 68.58 147.61 0.11 Allowed Pre-proline 0 C--O 1.226 -0.159 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.178 175.11 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.434 ' HD2' ' OG ' ' A' ' 456' ' ' SER . 27.3 Cg_endo -61.64 -1.56 2.11 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.507 2.138 . . . . 0.0 111.748 177.684 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.35 -37.28 68.88 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.1 174.949 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.49 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 79.8 m -135.64 131.86 36.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.367 177.081 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -105.96 133.39 50.75 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.979 -177.818 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -85.82 132.68 34.06 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 174.689 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -157.31 128.98 6.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.056 -0.257 . . . . 0.0 111.01 -178.132 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.54 -70.59 0.37 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.015 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -175.57 31.69 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 177.471 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.1 m -151.23 134.85 16.32 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -177.014 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 17.0 t -84.97 125.82 33.01 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.049 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.491 ' HA ' ' HB2' ' A' ' 446' ' ' CYS . 22.5 pttp -156.79 144.01 18.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.671 0.272 . . . . 0.0 111.065 -176.247 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.887 -176.987 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.789 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 73.2 m . . . . . 0 N--CA 1.439 -0.997 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -67.42 105.67 1.87 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.104 179.872 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 137.52 -28.19 2.79 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.213 -179.643 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -86.6 154.34 21.12 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.416 -176.902 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.57 177.44 30.06 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.83 -176.253 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.01 -50.74 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.844 -0.209 . . . . 0.0 110.973 -177.9 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -68.18 -31.07 70.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.936 0.398 . . . . 0.0 110.535 179.55 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.55 -34.73 72.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.02 178.571 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 48.9 t -60.12 116.76 4.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.23 179.842 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.492 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 35.9 mtmm -81.04 124.78 29.46 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.709 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.425 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 9.6 m -62.93 -54.08 49.92 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -172.418 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.5 Cg_endo -62.08 -28.37 80.05 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.475 1.45 . . . . 0.0 111.235 178.976 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.492 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 45.3 t0 -75.03 -50.96 14.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.972 178.089 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.498 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 98.2 m -148.54 148.39 30.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.404 0.621 . . . . 0.0 111.509 -175.169 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -92.35 139.58 30.45 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.282 177.241 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 48.9 t-105 -77.2 119.78 21.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.158 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -149.3 130.42 14.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.84 0.352 . . . . 0.0 110.454 -176.587 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.75 38.27 91.66 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.377 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.95 84.01 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.258 -0.496 . . . . 0.0 112.313 -177.815 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 85.9 m -150.82 135.84 17.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.695 0.283 . . . . 0.0 110.287 -177.002 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.789 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 20.0 t -78.63 124.94 28.7 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -161.39 134.28 6.21 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.137 0.494 . . . . 0.0 111.39 -174.907 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . 0.433 ' HB3' ' HA ' ' A' ' 459' ' ' CYS . 29.4 p-10 . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.642 177.91 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.881 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 81.9 m . . . . . 0 N--CA 1.453 -0.286 0 CA-C-O 120.797 0.332 . . . . 0.0 110.425 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 1.1 tmtp? -52.76 127.41 23.18 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.543 -178.795 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 108.89 -28.57 11.03 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.606 -178.868 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.881 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 57.0 mtmt -72.28 144.68 48.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.793 0.296 . . . . 0.0 111.132 -178.888 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.84 175.25 34.92 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 175.935 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.52 -37.09 74.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 117.346 0.573 . . . . 0.0 111.459 -177.253 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -68.6 -41.67 79.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.234 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . 0.613 ' HB3' ' HD2' ' A' ' 449' ' ' LYS . 1.1 m-20 -75.96 -36.87 59.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 110.56 178.852 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.48 ' SG ' ' N ' ' A' ' 455' ' ' LYS . 36.9 t -77.55 -157.73 0.1 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.351 179.589 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 454' ' ' CYS . 27.7 mmmt 61.36 49.67 5.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.862 0.839 . . . . 0.0 110.749 -175.282 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.46 ' C ' ' H ' ' A' ' 458' ' ' ASP . 0.9 OUTLIER -71.77 171.72 8.59 Favored Pre-proline 0 C--N 1.31 -1.127 0 CA-C-N 114.438 -1.255 . . . . 0.0 108.974 176.06 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 456' ' ' SER . 71.8 Cg_endo -77.57 29.07 0.43 Allowed 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.102 1.868 . . . . 0.0 111.097 175.949 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' A' ' 456' ' ' SER . 49.6 t0 -158.52 -49.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.489 -179.121 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 69.3 m -79.34 137.54 37.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.991 -179.484 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -115.22 160.48 19.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.306 0.574 . . . . 0.0 111.594 -178.563 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.449 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 37.1 t-105 -91.46 136.27 33.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.79 179.202 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.54 ' O ' HG22 ' A' ' 465' ' ' THR . 36.8 tt0 -128.24 75.38 1.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.944 0.402 . . . . 0.0 111.691 -177.59 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 60.78 57.96 16.19 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.756 175.383 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 78.99 40.79 15.69 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.947 178.762 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.54 HG22 ' O ' ' A' ' 462' ' ' GLU . 6.3 t -166.87 143.12 4.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 175.334 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.621 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 36.6 t -98.91 139.73 34.13 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.576 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 21.9 pttp -153.54 152.13 30.58 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.993 0.425 . . . . 0.0 111.103 -178.363 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.337 175.251 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.753 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 59.0 m . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -56.01 107.71 0.38 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.31 -173.65 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 78.32 56.07 3.8 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.673 -0.694 . . . . 0.0 113.875 177.297 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.622 ' HG2' ' O ' ' A' ' 446' ' ' CYS . 14.5 ptpt -129.57 166.79 19.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.219 0.51 . . . . 0.0 110.692 173.451 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 165.11 54.68 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.086 -177.781 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.45 -35.11 78.57 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.318 0.247 . . . . 0.0 111.104 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 39.25 0.71 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.643 0.735 . . . . 0.0 110.388 176.694 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -156.28 -44.51 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.576 -178.566 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.48 129.46 39.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.039 176.507 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -106.73 117.76 34.91 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.325 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.51 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 26.1 t -56.95 -48.43 97.43 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -173.601 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.2 Cg_endo -58.01 -30.13 89.05 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.625 1.55 . . . . 0.0 112.187 -179.227 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -87.95 -45.08 10.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.156 -179.842 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.497 ' O ' ' HA ' ' A' ' 456' ' ' SER . 68.4 m -143.13 142.08 31.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.947 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -89.05 147.23 24.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.731 0.777 . . . . 0.0 112.008 -175.265 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -94.82 119.52 33.54 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.345 179.615 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -146.07 129.89 17.2 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.572 0.225 . . . . 0.0 110.756 -179.161 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.67 42.68 96.37 Favored Glycine 0 N--CA 1.454 -0.152 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.221 -178.929 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 57.18 34.71 67.52 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.061 -177.025 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 32.7 m -143.93 130.72 20.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.715 0.293 . . . . 0.0 110.874 -175.038 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.1 t -88.64 134.61 33.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.98 178.654 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -172.53 154.34 3.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 111.229 -179.448 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 7.6 t70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.306 -0.854 . . . . 0.0 109.478 175.057 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.796 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 70.8 m . . . . . 0 N--CA 1.451 -0.392 0 CA-C-O 120.624 0.25 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -61.58 130.87 48.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -173.323 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.5 17.01 79.81 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.52 -0.763 . . . . 0.0 114.4 175.187 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 449' ' ' LYS . . . . . 0.796 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 50.8 mtmt -93.19 137.94 32.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 117.972 0.886 . . . . 0.0 110.327 173.868 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.47 166.18 51.29 Favored Glycine 0 C--O 1.223 -0.538 0 C-N-CA 121.018 -0.611 . . . . 0.0 111.854 178.622 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 451' ' ' GLU . . . . . 0.424 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 37.1 tt0 -59.26 -34.71 72.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.033 0.444 . . . . 0.0 111.635 -177.218 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -69.67 -44.38 70.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.803 0.335 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.54 -44.35 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.603 -179.015 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 454' ' ' CYS . . . . . 0.553 ' SG ' ' HE3' ' A' ' 449' ' ' LYS . 0.3 OUTLIER -80.29 115.9 20.08 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.305 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -87.95 148.05 24.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 178.773 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 456' ' ' SER . . . . . 0.493 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -62.96 -51.75 68.69 Favored Pre-proline 0 C--N 1.322 -0.606 0 O-C-N 123.347 0.404 . . . . 0.0 111.605 -179.845 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 457' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.1 Cg_endo -61.81 -30.98 85.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.599 1.533 . . . . 0.0 111.46 176.584 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -71.71 -47.99 50.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.008 178.357 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 63.4 m -148.55 143.12 26.42 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.157 -173.584 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.02 124.28 23.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.956 0.408 . . . . 0.0 110.781 -178.303 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 461' ' ' TRP . . . . . 0.583 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 60.3 t-105 -107.08 126.56 52.51 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.685 178.339 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 462' ' ' GLU . . . . . 0.884 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 21.3 tt0 -90.61 -60.5 1.9 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.975 0.417 . . . . 0.0 110.133 -179.176 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 176.55 40.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 178.286 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 147.55 -41.78 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -176.215 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.6 m -104.84 134.17 48.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.469 -0.365 . . . . 0.0 111.311 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 466' ' ' CYS . . . . . 0.583 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 1.8 t -101.09 145.1 29.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.971 178.666 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 467' ' ' LYS . . . . . 0.884 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 0.5 OUTLIER -148.16 140.17 24.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.123 0.487 . . . . 0.0 111.53 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 5.9 t70 . . . . . 0 C--O 1.251 1.158 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.507 179.676 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 18.4 m -67.64 123.58 20.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.651 0.262 . . . . 0.0 110.626 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -167.11 -31.93 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.173 -175.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -149.52 -35.31 0.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.999 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 24.8 m 59.19 37.36 23.91 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.03 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 24.7 pttm -175.4 -34.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.782 176.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 24.2 m 68.59 135.97 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.75 0.656 . . . . 0.0 111.874 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -62.03 -48.6 82.24 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.816 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 16.7 m -88.57 147.09 38.78 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-O 120.611 0.243 . . . . 0.0 110.755 175.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -62.52 -31.56 80.2 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.818 2.346 . . . . 0.0 112.201 -178.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 12.1 t 60.32 52.36 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-O 121.377 0.608 . . . . 0.0 110.368 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 28.1 m -65.05 126.68 28.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.849 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -79.61 -53.42 6.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.556 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 4.9 t -171.58 141.31 1.47 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.637 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -142.98 47.76 1.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.554 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 11.9 t 42.99 48.07 5.07 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.864 0.84 . . . . 0.0 111.955 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -67.78 -29.14 68.26 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.867 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -68.35 -44.03 76.17 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.186 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -66.85 153.42 43.48 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.692 0.282 . . . . 0.0 110.874 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.1 36.86 0.24 Allowed 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.063 178.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 88.6 m 69.37 -57.91 0.52 Allowed 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.437 0.695 . . . . 0.0 111.361 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.6 m -154.54 103.54 2.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . 0.466 ' C ' ' H ' ' A' ' 445' ' ' LYS . . . -75.51 84.98 2.59 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.592 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -76.1 28.07 0.12 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.154 0.502 . . . . 0.0 111.897 -178.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.466 ' H ' ' C ' ' A' ' 443' ' ' ALA . 34.9 mmtp -89.37 -25.49 21.55 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.416 169.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.419 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 57.0 m -73.34 -45.12 57.05 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.786 175.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 14.3 tptm -60.73 118.15 6.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.598 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.52 -25.87 8.88 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.146 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.596 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 68.4 mttm -69.33 144.02 53.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.61 0.243 . . . . 0.0 111.565 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -77.79 176.12 53.98 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 171.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -56.31 -44.34 79.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.858 0.329 . . . . 0.0 111.24 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -64.91 -40.63 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 47.2 m-20 -69.33 -43.62 73.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.711 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 8.7 t -60.93 111.32 1.62 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.733 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.661 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 95.0 mttt -82.95 127.03 33.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.554 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 69.8 m -61.39 -49.0 89.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -58.37 -28.3 84.45 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 121.796 1.664 . . . . 0.0 111.96 177.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.661 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 0.7 OUTLIER -86.87 -45.67 10.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.991 -178.219 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.1 m -140.77 146.63 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.73 -172.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.499 ' HG3' ' HG3' ' A' ' 462' ' ' GLU . 24.7 tptp -88.7 112.9 23.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.478 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -83.87 106.92 15.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.504 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 51.4 mt-10 -138.42 132.33 31.22 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.154 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.19 41.39 99.47 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.685 -0.688 . . . . 0.0 112.836 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.06 36.29 92.09 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.319 -0.467 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 89.1 m -149.97 129.23 12.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.787 0.327 . . . . 0.0 110.511 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 22.8 t -87.53 126.51 34.96 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.504 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 52.1 pttt -151.4 142.57 23.22 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.569 0.699 . . . . 0.0 112.146 -174.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 C--O 1.247 0.972 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.446 175.791 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.725 0 N-CA-C 112.158 -0.377 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 7.9 m -90.34 -38.37 13.4 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.831 0.348 . . . . 0.0 110.881 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . 0.764 ' HA ' ' HE2' ' A' ' 423' ' ' LYS . 10.8 mmpt? -66.19 130.39 43.07 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.819 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -89.09 45.43 1.29 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.992 -177.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . 0.503 ' HB2' HG12 ' A' ' 429' ' ' VAL . 24.6 m -77.59 116.53 18.22 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 176.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 46.3 tttp -76.0 -46.78 27.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.793 -172.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 21.3 m -82.76 49.24 1.45 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.692 0.282 . . . . 0.0 111.246 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 76.34 133.72 0.5 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.127 -0.558 . . . . 0.0 112.578 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.503 HG12 ' HB2' ' A' ' 425' ' ' SER . 15.4 m -80.53 127.23 76.42 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-O 120.958 0.408 . . . . 0.0 110.732 178.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 2.6 Cg_exo -75.37 49.66 2.42 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.291 2.66 . . . . 0.0 111.498 178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 8.1 p -80.0 39.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 121.711 0.767 . . . . 0.0 111.324 -175.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.4 m -78.6 53.34 1.31 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.69 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.747 ' HA ' HG21 ' A' ' 441' ' ' THR . 74.8 mt-30 -149.91 25.56 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.112 -178.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 437' ' ' ALA . 8.4 m -83.71 135.9 34.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.871 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -76.6 130.12 37.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.288 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 24.2 m 72.0 -59.23 0.56 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.392 0.677 . . . . 0.0 112.146 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.464 ' O ' ' HB ' ' A' ' 434' ' ' THR . . . -72.94 104.75 4.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.74 0.305 . . . . 0.0 110.78 179.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 69.16 46.28 58.63 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 -176.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -75.76 41.27 0.2 Allowed 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -177.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -72.19 -30.42 64.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.279 0.561 . . . . 0.0 110.258 175.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.747 HG21 ' HA ' ' A' ' 433' ' ' GLN . 1.4 t -63.73 -37.45 87.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.648 176.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 25.2 m -75.73 124.57 27.49 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.31 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -88.41 78.3 7.94 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 172.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -64.5 120.82 13.02 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.994 0.902 . . . . 0.0 111.026 -169.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -146.55 -39.06 0.22 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.311 -1.313 . . . . 0.0 108.127 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.686 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 42.5 m -71.6 -33.48 69.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.465 172.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -53.0 128.46 27.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.266 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 100.33 -22.76 38.59 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.023 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -71.04 137.46 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.959 0.409 . . . . 0.0 112.097 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.22 176.75 49.5 Favored Glycine 0 N--CA 1.444 -0.788 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 171.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -63.89 -43.4 96.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 117.193 0.497 . . . . 0.0 110.413 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 10.2 mptt -82.45 37.5 0.51 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.368 0.604 . . . . 0.0 111.016 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.73 -41.66 0.1 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.6 t -54.68 108.52 0.4 Allowed 'General case' 0 C--O 1.237 0.406 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.463 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.473 ' HB3' ' HB2' ' A' ' 458' ' ' ASP . 0.3 OUTLIER -71.11 126.97 31.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.108 178.44 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.524 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.6 m -67.55 -46.99 47.44 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.838 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 456' ' ' SER . 24.8 Cg_endo -61.83 -36.21 74.44 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.187 1.258 . . . . 0.0 111.772 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.473 ' HB2' ' HB3' ' A' ' 455' ' ' LYS . 9.3 m-20 -79.47 -39.82 31.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.177 -178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 10.3 m -133.35 -148.63 0.34 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.962 -171.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.537 ' HG3' ' HB2' ' A' ' 467' ' ' LYS . 9.9 ptpp? -167.51 149.13 5.63 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -97.94 133.19 42.76 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.506 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -139.86 122.69 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.41 -92.66 0.13 Allowed Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 -176.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -147.62 36.07 1.18 Allowed Glycine 0 N--CA 1.439 -1.147 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 1.9 p -140.62 144.15 35.59 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.293 0.568 . . . . 0.0 112.332 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.686 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 19.6 t -81.7 109.48 16.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.72 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.657 ' HE2' ' HA ' ' A' ' 467' ' ' LYS . 10.5 mmpt? -85.96 139.16 31.44 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.559 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.251 176.741 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.833 0 N-CA-C 111.88 -0.488 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 2.9 m -125.19 46.44 2.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.248 0.547 . . . . 0.0 110.767 -177.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -79.8 124.8 28.95 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -61.35 114.55 3.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.829 -176.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . 0.851 ' HB2' ' HD3' ' A' ' 430' ' ' PRO . 43.5 t -173.81 137.62 0.6 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.512 -176.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -67.86 -43.3 79.78 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 176.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 73.8 m -169.14 139.32 2.23 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.016 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 108.79 -41.93 2.09 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.245 -0.979 . . . . 0.0 113.574 177.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.41 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 86.8 t 69.98 122.33 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 123.003 0.521 . . . . 0.0 110.998 -176.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.851 ' HD3' ' HB2' ' A' ' 425' ' ' SER . 52.2 Cg_exo -57.96 -53.18 4.64 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.941 2.427 . . . . 0.0 112.912 -176.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 34.5 m -86.06 9.12 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.769 0.319 . . . . 0.0 111.246 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 61.7 p 48.46 -141.33 0.59 Allowed 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.102 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 50.8 -95.4 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.292 0.637 . . . . 0.0 111.721 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 8.5 m 72.78 -58.29 0.6 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.628 0.771 . . . . 0.0 111.756 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -167.92 132.1 1.73 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 9.0 t -168.36 29.81 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.193 0.521 . . . . 0.0 110.474 -177.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -72.65 -48.86 35.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.171 176.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -87.82 -37.87 7.73 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.125 173.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 56.8 -141.7 0.79 Allowed 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.975 0.456 . . . . 0.0 110.675 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -127.39 40.33 3.72 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.642 0.734 . . . . 0.0 109.86 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.08 49.88 1.73 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.707 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.408 HG22 ' HB2' ' A' ' 444' ' ' GLU . 34.1 m 66.14 86.58 0.13 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.659 -176.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -75.64 42.12 0.22 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.212 178.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.481 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 13.3 tp10 -67.51 121.01 14.9 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.813 -178.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -74.53 -28.81 61.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.288 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.481 ' SG ' ' HG3' ' A' ' 444' ' ' GLU . 20.0 p -70.52 -30.85 67.73 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.3 tttm -61.43 105.24 0.49 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.592 173.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 136.74 -32.88 2.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.912 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 9.9 mmmm -65.76 142.45 57.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.273 . . . . 0.0 110.292 177.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.73 -176.85 22.46 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.141 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.53 -45.21 94.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.899 0.349 . . . . 0.0 111.19 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -71.29 -42.08 69.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 110.557 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.912 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.8 OUTLIER -65.03 -31.42 72.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.369 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.416 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 9.7 t -70.42 89.18 0.68 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.21 0.528 . . . . 0.0 109.736 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.418 ' HB3' ' HD2' ' A' ' 457' ' ' PRO . 97.2 mttt -83.97 147.4 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.189 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.476 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 15.4 m -60.77 -48.57 92.64 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 17.4 Cg_exo -64.66 -27.2 60.8 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.583 1.522 . . . . 0.0 111.487 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -82.47 -40.97 20.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.515 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.471 ' SG ' ' N ' ' A' ' 460' ' ' LYS . 22.1 t -162.99 -151.54 0.19 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.263 0.554 . . . . 0.0 111.103 -171.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.471 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 42.4 mmtm -147.2 127.67 14.07 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.577 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.416 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 67.0 t-105 -88.69 118.44 28.37 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -75.62 -72.21 0.33 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -178.2 41.09 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 155.32 -33.03 0.65 Allowed Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -176.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 28.0 m -132.46 136.89 47.01 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 120.874 0.369 . . . . 0.0 110.545 -179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 8.2 t -75.28 144.24 42.6 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -177.27 126.97 0.15 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.387 0.613 . . . . 0.0 111.229 -176.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.572 -178.321 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 111.596 -0.602 . . . . 0.0 111.596 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . 0.427 ' HB ' ' H ' ' A' ' 423' ' ' LYS . 15.0 p -128.66 -143.02 0.26 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.649 0.224 . . . . 0.0 110.822 178.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . 0.427 ' H ' ' HB ' ' A' ' 422' ' ' THR . 58.1 mtpt -74.74 -36.2 62.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.791 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 62.11 38.61 13.71 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.594 0.711 . . . . 0.0 109.775 -174.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.82 133.11 44.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.297 -177.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -67.41 -36.94 82.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.802 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 6.7 m 57.88 42.1 23.64 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.453 178.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 75.45 -59.99 2.84 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.059 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 4.9 m -139.93 121.89 9.83 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-O 121.006 0.431 . . . . 0.0 110.186 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.05 135.02 33.54 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.505 2.136 . . . . 0.0 111.984 -178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 7.5 p -149.61 58.16 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 122.088 0.947 . . . . 0.0 109.368 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 3.4 m 74.92 139.13 0.06 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.566 -176.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -72.12 53.17 0.26 Allowed 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -175.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . 0.759 ' HB ' ' HB2' ' A' ' 439' ' ' ALA . 8.4 t -97.38 50.78 1.07 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.918 0.866 . . . . 0.0 109.811 174.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -81.89 -123.91 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.56 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 7.3 m -62.75 -50.18 72.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.003 0.43 . . . . 0.0 110.032 175.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -83.77 147.37 27.64 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.229 173.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -64.16 146.53 50.41 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.184 -0.532 . . . . 0.0 112.522 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . 0.759 ' HB2' ' HB ' ' A' ' 434' ' ' THR . . . -64.44 142.75 58.31 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 122.152 0.181 . . . . 0.0 111.075 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -75.25 66.71 1.77 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.168 0.509 . . . . 0.0 110.644 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 7.3 t -69.18 -30.81 69.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.169 -177.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.0 m -56.01 121.76 10.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.808 -176.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -78.06 132.67 37.84 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.803 175.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.894 ' HA ' ' HB3' ' A' ' 447' ' ' LYS . 34.5 tt0 -98.2 37.31 1.46 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.663 0.744 . . . . 0.0 111.315 -175.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -85.82 -40.53 15.91 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 169.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 454' ' ' CYS . 17.4 m -93.38 -33.86 13.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.12 174.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.894 ' HB3' ' HA ' ' A' ' 444' ' ' GLU . 16.1 tppt? -58.6 117.36 4.45 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 178.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 121.03 -28.99 5.91 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.969 -175.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -73.1 146.5 45.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.683 0.277 . . . . 0.0 111.339 -179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -81.76 173.72 53.81 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.59 173.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -63.6 -33.16 75.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -83.12 35.47 0.49 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.257 0.551 . . . . 0.0 111.269 177.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -160.08 -50.92 0.05 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.631 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.5 OUTLIER -72.46 120.6 18.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.027 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.495 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 16.4 ptpt -75.39 122.03 23.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.314 178.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . . . . . . . . . 21.1 m -69.57 -44.78 25.42 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -173.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.22 -40.61 81.38 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.179 1.253 . . . . 0.0 111.531 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.495 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 27.5 t70 -80.68 -43.46 20.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.753 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 88.3 m -121.6 133.88 55.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.164 0.507 . . . . 0.0 111.233 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.673 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 46.4 mttt -64.73 138.57 58.46 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.096 -176.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.45 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 61.3 t-105 -119.31 129.44 54.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.317 175.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -170.15 131.97 1.03 Allowed 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.214 0.321 . . . . 0.0 110.717 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 63.34 36.82 93.91 Favored Glycine 0 CA--C 1.517 0.192 0 CA-C-N 116.173 -0.467 . . . . 0.0 113.256 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.14 39.76 97.59 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.768 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.4 t -161.77 139.92 9.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.45 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 1.6 t -91.79 144.12 25.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.185 -176.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.673 ' HG2' ' HB2' ' A' ' 460' ' ' LYS . 0.0 OUTLIER -149.42 146.86 27.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.647 0.26 . . . . 0.0 110.811 -178.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 50.1 t0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.688 -0.672 . . . . 0.0 109.593 179.501 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.719 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.7 t -162.76 143.64 9.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.552 0.176 . . . . 0.0 110.64 -176.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 64.1 tttp 73.43 -51.81 0.7 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.792 0.837 . . . . 0.0 111.772 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 56.78 60.35 3.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.984 0.421 . . . . 0.0 111.28 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.7 m -60.27 137.77 58.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.752 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -79.5 55.55 1.98 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.347 0.594 . . . . 0.0 110.543 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 54.2 m -158.53 139.77 13.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.247 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -158.93 45.7 0.45 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.805 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.757 ' HB ' ' HD3' ' A' ' 430' ' ' PRO . 26.0 t -69.97 -56.5 7.31 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.757 ' HD3' ' HB ' ' A' ' 429' ' ' VAL . 17.8 Cg_endo -99.23 -142.96 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 123.996 3.131 . . . . 0.0 112.547 -176.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.4 ' H ' ' HB2' ' A' ' 430' ' ' PRO . 15.1 t 55.9 55.56 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.646 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 15.5 m 73.21 130.4 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.536 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -73.94 55.14 0.54 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.995 -174.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 35.0 p -81.01 -55.36 4.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.168 0.508 . . . . 0.0 110.092 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -87.97 -43.47 11.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.855 174.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.1 m 61.21 42.49 12.07 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.88 178.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 70.15 -47.42 0.62 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.603 0.761 . . . . 0.0 112.406 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 115.1 130.84 4.9 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.076 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 68.6 130.15 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.586 0.754 . . . . 0.0 112.14 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -81.34 144.21 31.65 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.493 177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 37.9 m -59.51 -38.16 80.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.927 0.394 . . . . 0.0 110.5 176.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 4.1 m -77.2 113.36 14.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.453 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -138.91 -29.46 0.77 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.835 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.572 ' HG2' ' H ' ' A' ' 468' ' ' ASP . 1.3 pp20? -41.4 133.34 2.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.898 -1.047 . . . . 0.0 113.073 -172.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -78.17 7.65 5.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.869 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.713 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 90.1 m -70.76 -36.18 72.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.024 175.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -52.78 115.35 1.78 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.787 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 122.4 -28.48 5.76 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.587 -176.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.697 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 22.5 mtmm -80.41 138.26 36.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.578 0.227 . . . . 0.0 111.474 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -76.64 -169.79 30.69 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -62.67 -46.04 90.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.95 0.375 . . . . 0.0 111.539 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -64.3 -34.19 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 111.045 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.2 -40.32 27.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.876 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 14.7 t -58.65 114.09 2.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.958 -177.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.845 ' HE3' ' HA ' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -87.51 125.39 34.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.019 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.543 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 m -60.8 -49.03 91.24 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.6 Cg_endo -60.11 -26.74 83.3 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.022 1.815 . . . . 0.0 112.078 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -87.85 -45.34 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.924 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 68.9 m -146.27 152.65 39.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.271 0.558 . . . . 0.0 111.63 -176.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.1 131.84 35.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.3 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -78.71 113.55 16.87 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -74.58 -47.26 33.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.006 0.431 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.71 -46.47 0.18 Allowed Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.226 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -140.07 31.53 2.26 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 177.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.7 t -170.94 145.31 2.32 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.026 0.441 . . . . 0.0 110.242 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.713 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 12.3 t -87.7 132.23 34.19 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.42 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 0.0 OUTLIER -158.29 153.19 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.838 -171.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.572 ' H ' ' HG2' ' A' ' 444' ' ' GLU . 28.2 t70 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.887 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 111.757 -0.537 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 13.5 t -152.07 32.72 0.53 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.529 0.68 . . . . 0.0 109.686 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 423' ' ' LYS . 0.2 OUTLIER 58.08 37.55 26.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.46 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -79.09 -58.28 3.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.99 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.2 m -104.19 -150.56 0.42 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.178 173.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -73.42 106.78 5.37 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 173.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 2.6 p -167.61 130.27 1.63 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.499 -175.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -74.55 -135.58 0.38 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.054 -0.594 . . . . 0.0 113.032 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 9.4 p -156.77 136.83 8.71 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -177.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.478 ' HB3' ' HB ' ' A' ' 434' ' ' THR . 51.9 Cg_exo -54.27 -43.53 57.74 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.564 2.176 . . . . 0.0 111.826 -178.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 8.0 p 43.64 50.86 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.213 1.005 . . . . 0.0 112.588 174.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 2.5 m 60.33 34.67 20.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.729 0.776 . . . . 0.0 110.486 176.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -155.8 46.56 0.48 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.254 -0.885 . . . . 0.0 108.669 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 430' ' ' PRO . 5.5 t -79.81 67.94 5.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.946 -176.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -63.69 -51.19 66.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.583 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 4.1 m 56.69 43.15 25.83 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.952 0.882 . . . . 0.0 110.522 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -84.62 -42.87 14.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.008 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 75.65 39.49 34.43 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.06 -175.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -152.92 39.01 0.52 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.291 0.567 . . . . 0.0 110.261 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -144.95 50.61 1.25 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.667 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 52.4 m -55.97 -42.89 76.97 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.079 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.58 HG22 ' CG ' ' A' ' 444' ' ' GLU . 22.8 m 71.72 -47.28 0.66 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.341 173.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 61.47 26.68 16.39 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.666 0.746 . . . . 0.0 110.606 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.58 ' CG ' HG22 ' A' ' 442' ' ' THR . 9.6 pt-20 -161.05 43.86 0.17 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.353 173.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -63.25 -27.68 69.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.892 174.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.513 ' SG ' ' HE2' ' A' ' 449' ' ' LYS . 3.6 t -69.9 -8.59 49.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.91 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 466' ' ' CYS . 55.0 tttm -59.37 128.82 39.01 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.361 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.05 -34.6 2.51 Favored Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -176.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.627 ' HB3' ' HB2' ' A' ' 453' ' ' ASP . 49.2 mtmt -76.63 139.86 40.76 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 177.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -66.95 174.51 25.44 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.85 -0.691 . . . . 0.0 111.45 176.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -58.01 -37.29 74.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.21 -43.48 74.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.383 . . . . 0.0 110.684 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.627 ' HB2' ' HB3' ' A' ' 449' ' ' LYS . 3.6 m-20 -72.07 -39.97 68.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.718 -179.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -73.97 71.22 1.55 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.92 176.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.77 ' HG3' ' HD2' ' A' ' 457' ' ' PRO . 20.7 tptm -64.29 135.06 55.86 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.53 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.551 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 37.2 m -53.72 -51.94 71.95 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -173.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.77 ' HD2' ' HG3' ' A' ' 455' ' ' LYS . 36.2 Cg_exo -61.18 -32.85 91.22 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 121.582 1.521 . . . . 0.0 111.553 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -77.58 -44.7 27.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.727 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 96.9 m -149.71 147.47 28.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 0.0 110.843 -175.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.722 ' HB2' ' HG3' ' A' ' 467' ' ' LYS . 49.4 mmtm -79.19 129.86 34.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.452 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -107.79 125.84 51.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.522 ' HB2' ' NZ ' ' A' ' 467' ' ' LYS . 12.7 tp10 -86.75 -131.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . 0.451 ' H ' ' HG3' ' A' ' 462' ' ' GLU . . . -82.3 -41.11 9.48 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.443 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -159.08 45.4 0.45 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.43 ' OG1' ' HE2' ' A' ' 447' ' ' LYS . 9.6 t -163.4 136.73 5.63 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.547 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 447' ' ' LYS . 11.2 t -90.01 145.86 24.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.959 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.722 ' HG3' ' HB2' ' A' ' 460' ' ' LYS . 9.4 ptpp? -144.88 160.48 41.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.666 0.269 . . . . 0.0 110.391 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.736 -0.65 . . . . 0.0 110.821 -176.977 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.772 0 N-CA-C 111.762 -0.535 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 18.4 m 66.54 73.91 0.35 Allowed 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.246 0.546 . . . . 0.0 110.383 -177.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -66.75 112.73 4.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.846 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -165.94 -95.35 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.04 178.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 23.2 t -67.2 -41.23 86.16 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -100.68 129.94 46.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.208 176.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 48.8 m -155.62 142.79 19.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.954 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 173.28 -125.78 1.17 Allowed Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 -177.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.558 ' HB ' HG23 ' A' ' 431' ' ' VAL . 29.0 m 44.26 107.25 0.01 OUTLIER Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 124.73 1.212 . . . . 0.0 113.59 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.67 52.04 3.19 Favored 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 123.372 2.715 . . . . 0.0 112.063 177.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.777 HG21 HG23 ' A' ' 441' ' ' THR . 2.5 t -95.7 28.87 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.292 0.568 . . . . 0.0 110.164 -178.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 15.4 m -76.71 -47.91 20.46 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.584 177.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -158.51 50.34 0.39 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.138 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 32.3 m -155.18 100.59 2.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.489 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . 0.698 ' HA ' ' HB2' ' A' ' 440' ' ' ASP . 0.4 OUTLIER -128.69 152.94 47.83 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.185 -175.878 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 3.1 m -54.52 -62.96 1.31 Allowed 'General case' 0 CA--C 1.532 0.26 0 O-C-N 123.277 0.36 . . . . 0.0 111.164 -176.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -162.93 31.23 0.1 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.323 0.582 . . . . 0.0 110.383 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 161.3 -40.12 0.41 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.482 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -160.41 131.09 5.48 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . 0.698 ' HB2' ' HA ' ' A' ' 435' ' ' GLN . 38.4 t70 -87.69 -43.0 12.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.281 0.562 . . . . 0.0 110.021 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.777 HG23 HG21 ' A' ' 431' ' ' VAL . 7.8 p -82.54 120.17 25.17 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.399 172.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.72 HG22 ' HG2' ' A' ' 444' ' ' GLU . 37.8 m -69.65 117.75 11.64 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.93 -175.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -79.36 48.95 0.93 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.087 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.871 ' HB2' ' HB2' ' A' ' 447' ' ' LYS . 51.6 mm-40 -58.59 121.44 10.96 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.32 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 445' ' ' LYS . 37.1 ttpt -58.41 -30.7 67.07 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.738 0.78 . . . . 0.0 109.208 173.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.674 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.0 m -79.02 -22.25 45.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.332 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.871 ' HB2' ' HB2' ' A' ' 444' ' ' GLU . 47.3 tptt -53.52 133.01 41.1 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 68.01 33.76 80.01 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.115 -0.948 . . . . 0.0 114.529 171.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.674 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 46.8 mtmt -119.44 147.47 44.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.444 0.622 . . . . 0.0 110.626 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.36 155.48 53.05 Favored Glycine 0 C--O 1.225 -0.409 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.8 -33.99 67.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.297 0.548 . . . . 0.0 111.361 -177.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -57.02 -40.91 77.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.968 0.414 . . . . 0.0 110.535 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.555 ' OD2' ' HD2' ' A' ' 449' ' ' LYS . 33.5 t70 -91.57 -49.18 6.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.061 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.575 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 0.8 OUTLIER -73.21 92.88 1.79 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 111.832 -177.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -152.7 135.04 15.06 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.58 ' C ' ' H ' ' A' ' 458' ' ' ASP . 2.8 t -167.36 149.99 5.69 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.617 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -73.74 26.07 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.395 2.064 . . . . 0.0 109.798 172.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.58 ' H ' ' C ' ' A' ' 456' ' ' SER . 35.2 t70 -151.5 -43.23 0.11 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.569 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 456' ' ' SER . 73.8 m -71.75 138.87 48.77 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.393 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.409 ' HB3' ' NZ ' ' A' ' 460' ' ' LYS . 6.2 ttpm? -113.3 137.42 51.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.861 0.362 . . . . 0.0 110.719 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.759 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 58.7 t-105 -95.84 122.33 38.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.745 177.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.587 ' HG3' ' HE3' ' A' ' 467' ' ' LYS . 48.0 mm-40 -82.4 -38.43 24.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.186 0.517 . . . . 0.0 110.822 -178.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 155.49 -50.31 0.46 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -134.57 29.85 2.95 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 174.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.3 t -175.0 145.18 0.8 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.109 -0.545 . . . . 0.0 109.727 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.759 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 15.8 t -112.76 132.6 55.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.375 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.587 ' HE3' ' HG3' ' A' ' 462' ' ' GLU . 22.4 pttp -178.12 142.67 0.28 Allowed 'General case' 0 C--O 1.233 0.209 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 40.2 t0 . . . . . 0 C--O 1.253 1.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.914 175.94 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.746 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 10.0 t -155.17 136.9 14.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.888 0.375 . . . . 0.0 109.997 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -73.33 130.85 41.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.635 -177.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.591 ' HB3' ' HB2' ' A' ' 427' ' ' SER . . . -83.52 161.6 21.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.143 175.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 7.5 p -74.86 36.61 0.11 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp 178.71 -47.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . 0.591 ' HB2' ' HB3' ' A' ' 424' ' ' ALA . 20.1 m -59.68 138.34 57.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.324 -177.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 125.86 -53.68 0.77 Allowed Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.351 -1.1 . . . . 0.0 110.351 -174.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 35.6 t 56.37 99.58 0.04 OUTLIER Pre-proline 0 C--O 1.235 0.33 0 C-N-CA 123.234 0.614 . . . . 0.0 112.216 173.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -68.53 122.52 9.5 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.338 2.025 . . . . 0.0 110.057 174.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.415 HG12 ' H ' ' A' ' 434' ' ' THR . 21.5 t -72.07 111.24 5.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.004 0.43 . . . . 0.0 110.098 -176.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 27.6 m -85.76 -45.62 11.45 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.17 -175.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -69.18 -52.67 25.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.889 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . 0.415 ' H ' HG12 ' A' ' 431' ' ' VAL . 1.9 p 50.13 62.68 2.54 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.091 0.472 . . . . 0.0 110.635 -175.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 64.12 -131.85 0.36 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.303 -175.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 4.7 p -69.47 94.91 0.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.887 0.375 . . . . 0.0 111.231 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.8 137.75 44.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.041 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 62.83 -123.68 30.93 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.475 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -156.58 -136.62 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 2.8 p30 43.81 34.99 0.97 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.038 0.935 . . . . 0.0 112.899 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 15.2 t -90.73 129.35 36.83 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.056 0.455 . . . . 0.0 110.12 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.436 HG23 ' H ' ' A' ' 445' ' ' LYS . 10.3 t -170.01 -151.92 0.09 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.27 -176.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -67.27 -53.86 26.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.754 0.312 . . . . 0.0 110.673 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -168.12 47.5 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.932 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.445 ' HG3' ' HB3' ' A' ' 468' ' ' ASP . 0.0 OUTLIER 66.42 30.48 8.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.653 177.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.584 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 85.2 m 63.48 20.99 12.55 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.324 175.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -78.73 134.73 37.04 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.808 -177.225 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.7 32.82 35.98 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.509 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -113.51 143.12 45.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.45 163.76 52.91 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.604 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.63 -40.38 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.151 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' A' ' 452' ' ' LYS . 12.5 mptt -74.39 -34.6 63.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -71.61 -45.48 61.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 0.0 110.03 177.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.465 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.1 t -60.45 133.08 55.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.179 176.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 455' ' ' LYS . 30.7 mmtp -128.7 134.4 48.47 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.554 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 8.7 m -54.37 -50.74 83.3 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -173.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.554 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 31.9 Cg_exo -59.02 -28.22 87.25 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.824 1.683 . . . . 0.0 111.267 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -81.22 -54.58 5.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.548 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 467' ' ' LYS . 95.1 m -155.8 158.88 38.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.101 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -89.37 137.67 32.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.939 0.4 . . . . 0.0 111.459 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.465 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 66.3 t-105 -89.25 117.99 28.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.66 174.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.51 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 6.0 mm-40 -119.05 116.62 26.78 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.958 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 66.15 -66.75 0.14 Allowed Glycine 0 C--N 1.333 0.385 0 O-C-N 123.807 0.692 . . . . 0.0 113.476 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -170.36 38.58 0.19 Allowed Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.403 HG23 ' HE3' ' A' ' 467' ' ' LYS . 14.5 t -159.8 139.98 11.79 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.584 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.7 t -94.82 139.03 31.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -174.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.51 ' HD3' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -155.55 151.87 28.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.34 . . . . 0.0 111.147 -177.568 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.445 ' HB3' ' HG3' ' A' ' 445' ' ' LYS . 10.1 p-10 . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.781 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.96 0 N-CA-C 112.405 -0.278 . . . . 0.0 112.405 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 14.4 t -148.78 -174.24 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp 72.07 142.16 0.06 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.632 0.583 . . . . 0.0 111.015 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -57.58 140.62 50.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.251 -178.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 24.3 m -59.48 129.13 40.49 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.805 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -175.5 -46.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.59 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 15.0 m -65.88 -35.61 81.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.373 -178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 83.35 -127.77 8.19 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.347 -175.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 6.1 p -151.59 126.09 4.57 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-O 120.907 0.384 . . . . 0.0 110.545 178.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.66 -39.65 20.21 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.537 2.158 . . . . 0.0 111.452 -178.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.59 131.2 33.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.945 176.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 6.1 m -60.31 124.14 19.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.603 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -156.72 -57.41 0.09 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.257 -177.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 1.7 p -85.0 -69.11 0.67 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.756 -175.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 88.4 mm-40 67.13 -63.47 0.28 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.644 0.778 . . . . 0.0 111.966 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 71.1 p 51.02 -139.36 0.95 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.508 0.723 . . . . 0.0 111.096 -178.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 64.4 157.86 0.09 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.29 0.567 . . . . 0.0 112.164 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 179.81 135.28 2.4 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.65 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -105.26 46.45 0.92 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 35.5 t70 72.38 120.19 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.529 -177.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 11.6 m -75.01 -57.07 4.13 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.14 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.2 m -162.95 114.93 1.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.115 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -77.83 127.61 32.68 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 447' ' ' LYS . 35.1 mt-10 -78.42 67.69 4.26 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.075 0.464 . . . . 0.0 111.415 -176.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -69.14 -15.29 63.38 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.972 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.579 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 24.9 p -166.86 -31.59 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.932 -174.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.674 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 60.2 tttm -43.75 120.0 1.87 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.826 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 116.99 -32.83 5.31 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.257 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -61.58 152.81 29.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.009 0.433 . . . . 0.0 111.809 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.48 166.52 54.61 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.045 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -55.3 -50.76 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 26.5 tttm -63.85 -43.0 97.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.835 0.35 . . . . 0.0 110.801 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -67.19 -42.91 83.41 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.709 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.427 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 12.1 t -60.45 105.68 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.2 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 455' ' ' LYS . 38.7 mmtm -165.38 43.58 0.08 Allowed 'General case' 0 CA--C 1.498 -1.032 0 CA-C-O 121.854 0.835 . . . . 0.0 108.928 176.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.712 ' HB2' ' CB ' ' A' ' 459' ' ' CYS . 50.3 m -72.19 135.12 82.41 Favored Pre-proline 0 C--N 1.296 -1.737 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.935 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.75 24.44 0.29 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.559 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.685 ' H ' ' C ' ' A' ' 456' ' ' SER . 46.0 t0 -148.69 -27.86 0.3 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 112.818 -1.992 . . . . 0.0 108.84 -176.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.712 ' CB ' ' HB2' ' A' ' 456' ' ' SER . 13.7 t -88.49 -174.77 4.72 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.039 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.466 ' N ' ' SG ' ' A' ' 459' ' ' CYS . 5.4 mmmm -158.41 135.02 9.55 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.356 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.427 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 56.3 t-105 -85.79 122.21 29.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -156.68 130.01 8.05 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.894 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.99 36.76 92.45 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.298 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.62 82.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.604 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -157.9 142.45 16.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.357 0.598 . . . . 0.0 110.945 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.674 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 5.5 t -79.32 142.1 36.4 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.1 pttp 178.07 137.87 0.08 Allowed 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.048 0.451 . . . . 0.0 111.217 -177.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 54.1 t0 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.506 -0.759 . . . . 0.0 109.446 174.926 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.874 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.52 129.68 38.49 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.932 0.366 . . . . 0.0 111.242 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 52.6 tttm 71.26 -54.16 0.67 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.164 0.986 . . . . 0.0 112.375 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -87.25 -163.56 0.94 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.575 0.226 . . . . 0.0 111.257 -178.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 6.5 t 59.48 37.24 23.04 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.721 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -93.81 142.47 27.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.479 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.2 t -162.6 41.17 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.593 0.711 . . . . 0.0 109.21 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 165.81 147.63 5.24 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.869 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.403 HG12 HG13 ' A' ' 431' ' ' VAL . 67.1 t 69.89 112.38 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.453 0 CA-C-O 121.277 0.56 . . . . 0.0 111.221 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -82.17 44.8 1.78 Allowed 'Trans proline' 0 CA--C 1.53 0.286 0 C-N-CA 123.007 2.471 . . . . 0.0 113.663 -176.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.403 HG13 HG12 ' A' ' 429' ' ' VAL . 3.1 m -75.97 129.83 36.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.786 0.326 . . . . 0.0 110.927 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 433' ' ' GLN . 7.0 t 177.67 -31.0 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.438 -178.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 432' ' ' THR . 68.8 mt-30 73.74 -58.19 0.6 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.705 0.802 . . . . 0.0 111.327 -178.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.6 t -83.06 60.06 5.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 122.04 0.924 . . . . 0.0 110.36 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -62.48 -49.97 73.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.186 -0.916 . . . . 0.0 111.426 -176.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 439' ' ' ALA . 11.5 p -71.17 -51.87 22.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.249 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 69.66 -53.61 0.61 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.655 0.782 . . . . 0.0 111.935 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -99.49 40.84 2.33 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.978 -0.63 . . . . 0.0 112.044 177.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . 0.473 ' HB3' ' HB ' ' A' ' 436' ' ' THR . . . -171.41 123.49 0.56 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 110.146 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -72.55 -34.3 67.43 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.759 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 22.1 p 50.86 46.69 25.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.585 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.5 m -81.95 -35.9 28.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.899 174.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 57.1 -116.9 1.0 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.528 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -118.06 43.13 2.51 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.074 0.464 . . . . 0.0 110.863 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -72.53 -34.21 67.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.359 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 79.3 m -76.07 -42.7 46.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.093 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -58.9 126.46 27.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.427 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 120.44 -31.44 5.24 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.512 -0.852 . . . . 0.0 111.597 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -70.09 139.48 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.751 0.31 . . . . 0.0 111.329 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.37 165.34 54.32 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.42 -48.36 71.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.179 0.489 . . . . 0.0 111.692 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -67.56 -34.47 77.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.033 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -74.0 -44.32 54.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.853 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.0 t -54.99 119.26 5.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.124 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -90.38 123.64 34.28 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.492 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 28.2 t -57.19 -49.3 94.7 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 39.7 Cg_exo -60.57 -29.94 89.58 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 121.854 1.702 . . . . 0.0 111.786 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -82.32 -49.12 10.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.116 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 20.2 m -140.81 135.95 31.94 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -80.08 122.57 26.94 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.979 0.418 . . . . 0.0 110.484 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.482 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 68.6 t-105 -84.3 126.37 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.46 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 8.9 tt0 -156.97 133.3 9.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.604 0.24 . . . . 0.0 110.734 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.25 34.53 89.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.514 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.18 37.68 95.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.818 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 13.3 t -155.87 141.81 18.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.429 . . . . 0.0 110.314 177.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.482 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 30.9 t -89.05 126.52 35.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.812 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 63.5 pttt -144.25 139.85 28.9 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.805 0.336 . . . . 0.0 110.473 -178.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.423 ' HB3' ' SG ' ' A' ' 446' ' ' CYS . 3.3 p30 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.636 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.707 0 N-CA-C 111.844 -0.503 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.3 m -77.34 59.92 1.92 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.567 0.698 . . . . 0.0 111.529 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -122.35 34.65 5.09 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.923 178.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -168.75 48.53 0.04 OUTLIER 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.343 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 44.1 m -59.51 130.11 45.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.234 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -66.68 -51.22 58.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.3 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 35.8 p 47.32 39.23 8.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.804 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -87.61 -45.28 5.26 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.625 178.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 3.4 p -162.71 123.64 1.52 Allowed Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 22.9 Cg_exo -68.65 128.69 17.46 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.66 2.24 . . . . 0.0 112.481 -175.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 33.4 m -85.91 -4.83 9.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.708 0.766 . . . . 0.0 110.373 176.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.2 p -72.22 135.99 46.24 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 114.701 -1.136 . . . . 0.0 111.214 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -62.52 131.98 50.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.97 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 31.5 m -58.7 -46.75 86.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.637 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -166.1 126.57 1.73 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.753 174.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 10.2 t -65.24 125.46 25.11 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.027 0.442 . . . . 0.0 110.473 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -169.15 142.73 2.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.98 -176.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 79.73 41.71 12.41 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.505 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -67.42 -34.4 77.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.789 0.328 . . . . 0.0 110.552 177.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 38.7 t70 62.16 52.24 3.28 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.042 -178.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 35.6 m -155.09 120.78 5.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.427 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 32.5 m -78.75 119.71 22.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.328 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -75.57 -27.18 58.48 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.884 178.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.431 ' C ' ' H ' ' A' ' 446' ' ' CYS . 6.2 tp10 -45.6 125.64 6.07 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.647 -173.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.42 ' O ' ' HE2' ' A' ' 449' ' ' LYS . 15.3 ttmm -74.16 42.4 0.15 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.522 -178.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.431 ' H ' ' C ' ' A' ' 444' ' ' GLU . 58.1 m -145.58 5.42 1.05 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.739 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -78.01 106.81 10.13 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.302 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 59.07 47.39 91.03 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.326 -0.852 . . . . 0.0 114.067 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.8 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 26.9 mtmt -107.55 -169.38 1.52 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.296 0.548 . . . . 0.0 110.25 174.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.44 154.1 36.08 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.29 -35.58 75.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.925 0.363 . . . . 0.0 110.453 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -57.77 -48.37 79.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.412 177.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.625 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.4 OUTLIER -68.92 -54.58 14.66 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.093 176.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.8 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 27.6 m -70.98 96.15 1.26 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.014 -0.994 . . . . 0.0 112.826 -174.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -145.9 142.51 28.83 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.561 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.569 ' C ' ' H ' ' A' ' 458' ' ' ASP . 3.3 t 174.71 149.26 0.25 Allowed Pre-proline 0 C--N 1.317 -0.814 0 O-C-N 124.138 0.899 . . . . 0.0 109.113 -178.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.76 27.88 0.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.268 1.979 . . . . 0.0 109.945 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.569 ' H ' ' C ' ' A' ' 456' ' ' SER . 11.6 t70 -150.58 -43.36 0.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.961 -177.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 456' ' ' SER . 62.1 m -68.56 134.32 49.84 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 174.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -125.34 149.76 47.81 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.848 -175.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.514 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 29.7 t-105 -101.49 131.03 47.84 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.667 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.591 ' HB3' ' HE2' ' A' ' 467' ' ' LYS . 40.0 tp10 -158.73 122.08 3.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.821 0.343 . . . . 0.0 110.905 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.37 41.55 98.07 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.52 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.1 41.85 99.67 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.12 -0.562 . . . . 0.0 112.764 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -169.97 147.86 3.36 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.06 0.457 . . . . 0.0 110.451 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.514 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.6 OUTLIER -95.27 145.42 25.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.255 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.591 ' HE2' ' HB3' ' A' ' 462' ' ' GLU . 62.3 pttt -157.25 149.05 22.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.049 0.452 . . . . 0.0 111.933 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 59.9 t0 . . . . . 0 C--O 1.248 1.009 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.103 174.723 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.625 0 N-CA-C 112.083 -0.407 . . . . 0.0 112.083 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 3.4 m 59.28 48.95 9.57 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.196 0.522 . . . . 0.0 110.828 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . 0.71 ' HA ' ' HA2' ' A' ' 428' ' ' GLY . 0.0 OUTLIER -165.38 145.02 6.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.734 176.702 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -151.65 -63.53 0.18 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.008 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 31.1 t -170.09 -55.48 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -80.61 -43.4 20.59 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -173.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.8 t -171.59 69.52 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.989 0.423 . . . . 0.0 111.112 -176.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . 0.71 ' HA2' ' HA ' ' A' ' 423' ' ' LYS . . . 66.93 -127.49 27.85 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.215 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.665 HG22 ' H ' ' A' ' 431' ' ' VAL . 5.1 p -64.83 124.04 85.3 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-O 120.927 0.394 . . . . 0.0 110.036 176.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -79.66 1.43 9.22 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.61 2.207 . . . . 0.0 112.694 -176.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.665 ' H ' HG22 ' A' ' 429' ' ' VAL . 32.7 m 43.51 42.34 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.234 1.014 . . . . 0.0 112.097 -178.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 5.6 m -66.53 136.53 55.79 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.291 -178.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -151.06 -41.42 0.12 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.692 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 5.2 p -81.16 37.73 0.45 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.821 0.343 . . . . 0.0 111.754 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -139.71 90.39 2.39 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 175.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 5.1 m -136.71 140.9 42.98 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.47 -175.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 64.47 45.59 3.64 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 123.659 0.6 . . . . 0.0 111.478 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 64.13 49.24 68.04 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.865 177.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -69.41 132.37 46.24 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 178.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -63.84 115.32 4.72 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.832 0.349 . . . . 0.0 110.753 -178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 7.0 p -77.74 123.76 27.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.775 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.659 ' HA ' ' HB3' ' A' ' 468' ' ' ASP . 14.6 m -160.87 -51.75 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.427 178.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 56.14 35.71 26.14 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.025 0.44 . . . . 0.0 111.167 -178.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 51.79 35.49 15.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.729 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 442' ' ' THR . 0.0 OUTLIER -77.26 -33.18 55.95 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.495 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 67.5 m -148.79 18.8 1.01 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.781 -179.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -71.32 118.33 13.99 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.535 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 79.76 23.97 61.12 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.499 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 23.1 ttmm -90.41 138.4 31.57 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -71.19 164.62 53.7 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.741 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.13 -37.91 78.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 117.013 0.406 . . . . 0.0 111.783 -177.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -74.66 -39.61 61.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.825 0.345 . . . . 0.0 110.599 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -70.05 -40.69 74.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.797 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.532 ' SG ' ' HE3' ' A' ' 461' ' ' TRP . 42.0 t -61.53 125.97 25.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.624 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.462 ' HG3' ' HB3' ' A' ' 458' ' ' ASP . 7.8 ptpp? -124.79 132.28 53.36 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.333 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.517 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.5 m -52.83 -47.95 93.05 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.3 Cg_endo -59.51 -25.93 80.35 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.718 1.612 . . . . 0.0 111.94 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.462 ' HB3' ' HG3' ' A' ' 455' ' ' LYS . 26.0 t70 -92.99 -46.56 7.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.52 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.508 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 85.4 m -147.23 156.34 42.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 110.83 -178.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -90.03 120.27 31.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.64 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.532 ' HE3' ' SG ' ' A' ' 454' ' ' CYS . 70.6 t-105 -81.69 117.56 22.12 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -84.03 -37.65 21.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.02 0.438 . . . . 0.0 110.499 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 166.74 -46.03 0.26 Allowed Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.342 -0.703 . . . . 0.0 111.342 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -131.67 -10.3 2.36 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 11.2 m -130.26 136.03 48.74 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.967 0.413 . . . . 0.0 110.7 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 18.2 t -92.46 119.86 32.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.437 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.27 133.21 49.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.052 -175.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.659 ' HB3' ' HA ' ' A' ' 442' ' ' THR . 35.2 t70 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.576 -0.726 . . . . 0.0 110.869 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 3.6 m -69.17 -35.34 76.18 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.318 0.58 . . . . 0.0 110.414 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -111.93 49.12 0.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.062 176.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -161.16 136.54 7.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.434 -178.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.6 t -173.34 -133.59 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -44.52 88.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 29.0 t -77.99 146.48 35.39 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.248 175.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -149.91 -61.72 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 177.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 56.8 t -100.95 111.34 63.16 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 170.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -71.44 120.05 6.68 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.326 2.017 . . . . 0.0 112.167 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 35.8 m -84.94 35.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.386 0.612 . . . . 0.0 110.791 177.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 19.7 m -65.5 137.82 57.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.514 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -73.3 58.55 0.54 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.196 0.522 . . . . 0.0 110.576 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 20.0 m -160.56 -46.78 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.487 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -84.66 44.14 1.03 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.938 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.4 m -114.83 40.28 2.65 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.489 0.662 . . . . 0.0 109.996 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -74.65 143.24 44.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.162 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -87.12 47.39 3.67 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.043 -0.599 . . . . 0.0 111.937 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -85.05 57.06 4.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.737 0.303 . . . . 0.0 111.319 -177.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 44.0 t0 60.67 40.88 15.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.437 0.637 . . . . 0.0 110.441 -178.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 36.2 m -72.59 -39.74 67.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.393 176.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.686 HG21 ' HB2' ' A' ' 468' ' ' ASP . 7.4 m -151.45 158.28 43.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.335 177.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -61.09 -28.97 69.47 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.905 0.383 . . . . 0.0 110.335 177.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.618 ' HA ' ' OD1' ' A' ' 468' ' ' ASP . 78.6 mt-10 68.28 62.09 0.38 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.884 176.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.39 -29.1 24.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.49 -0.777 . . . . 0.0 108.918 172.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.447 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 76.7 m -79.48 -34.84 41.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.791 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -48.38 122.34 5.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.924 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 61.35 33.51 84.82 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.411 -0.813 . . . . 0.0 113.907 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.749 ' HD3' ' HA ' ' A' ' 454' ' ' CYS . 18.2 ptmt -85.31 -19.94 30.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.174 0.487 . . . . 0.0 110.954 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 103.65 150.78 21.88 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.806 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . 0.414 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 29.1 tt0 -63.37 -43.1 98.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 122.455 0.302 . . . . 0.0 111.44 -175.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.52 42.04 0.81 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.365 0.603 . . . . 0.0 110.563 177.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -160.62 -38.14 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.445 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 449' ' ' LYS . 19.9 t -74.49 73.98 1.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.09 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.5 132.83 47.65 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.3 m -50.19 -50.31 70.77 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -171.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 456' ' ' SER . 20.2 Cg_endo -61.6 -31.61 87.07 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.839 1.693 . . . . 0.0 111.688 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -83.29 -44.1 15.29 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.4 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.21 146.3 26.75 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -86.26 128.34 34.9 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.706 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.617 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 64.8 t-105 -96.13 111.15 23.27 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 174.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -82.88 47.11 1.16 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.978 0.418 . . . . 0.0 110.971 -176.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 57.95 38.13 87.78 Favored Glycine 0 C--N 1.33 0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.688 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 152.47 -37.48 0.79 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.179 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 24.4 m -123.16 129.16 51.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.201 . . . . 0.0 111.218 -177.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.617 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 23.2 t -82.01 138.06 34.97 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.33 141.43 32.36 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.01 0.433 . . . . 0.0 110.754 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.686 ' HB2' HG21 ' A' ' 442' ' ' THR . 1.8 m-20 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.994 -178.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.633 0 N-CA-C 111.737 -0.545 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.4 t -66.0 141.98 57.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.869 0.366 . . . . 0.0 110.345 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -154.41 46.87 0.58 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.768 0.794 . . . . 0.0 109.32 -177.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -73.76 125.81 28.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.693 -178.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 56.3 m -75.74 120.63 21.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.752 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -72.72 -37.5 67.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.248 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 49.4 m 66.97 123.86 0.02 OUTLIER 'General case' 0 C--O 1.235 0.322 0 O-C-N 124.072 0.857 . . . . 0.0 111.731 177.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 179.55 124.16 0.87 Allowed Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.233 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 35.4 m -73.46 135.8 78.58 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-O 120.795 0.331 . . . . 0.0 110.823 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -71.14 142.68 42.46 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.823 2.349 . . . . 0.0 111.861 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 14.2 p -166.65 139.02 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.259 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 20.3 m -65.78 -44.6 85.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.911 -176.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -123.65 122.94 39.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.85 174.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 12.6 t -74.03 139.73 44.93 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 70.63 123.65 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.019 -175.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 20.7 m -95.45 116.14 28.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.969 175.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -161.41 129.89 4.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.281 -178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 176.67 145.6 5.72 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.561 -0.616 . . . . 0.0 111.561 -178.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -62.64 -41.44 99.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.779 0.323 . . . . 0.0 110.678 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 4.6 t70 59.54 47.3 11.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.184 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 17.5 p -65.81 -40.84 92.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.193 -177.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 9.7 t -170.26 147.74 3.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.401 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -80.0 41.09 0.49 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.309 175.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.78 ' HB3' ' HB2' ' A' ' 447' ' ' LYS . 17.8 mm-40 59.37 67.36 0.91 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.856 -175.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -55.61 -35.11 65.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.933 172.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 2.9 m -77.62 -59.95 2.57 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.059 -178.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.78 ' HB2' ' HB3' ' A' ' 444' ' ' GLU . 81.1 tttt 33.07 75.67 0.05 OUTLIER 'General case' 0 C--O 1.235 0.294 0 N-CA-C 114.379 1.252 . . . . 0.0 114.379 176.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.702 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . 48.66 35.1 15.93 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 114.562 -1.199 . . . . 0.0 115.37 169.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.7 ' HG3' ' HB2' ' A' ' 454' ' ' CYS . 0.3 OUTLIER -85.81 149.45 25.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.921 0.86 . . . . 0.0 108.84 173.111 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -56.04 150.97 22.61 Favored Glycine 0 C--O 1.227 -0.318 0 C-N-CA 121.444 -0.408 . . . . 0.0 113.384 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.6 -33.48 66.27 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.79 -176.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 452' ' ' LYS . 27.3 mmtp -61.66 -37.93 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.87 0.367 . . . . 0.0 110.204 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -81.06 -48.04 12.74 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.781 175.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.7 ' HB2' ' HG3' ' A' ' 449' ' ' LYS . 0.5 OUTLIER -84.58 116.71 23.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.519 -173.715 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -89.43 139.81 30.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.837 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.538 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 10.5 t -58.78 -48.79 96.17 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.994 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 456' ' ' SER . 19.3 Cg_endo -58.51 -29.85 89.99 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.853 1.702 . . . . 0.0 112.007 178.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -84.05 -42.32 16.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 67.7 m -141.58 149.82 41.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.372 -173.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -79.37 135.69 36.78 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.998 0.428 . . . . 0.0 110.532 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 52.3 t-105 -106.28 132.35 52.44 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.855 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.422 ' OE2' ' HD2' ' A' ' 467' ' ' LYS . 30.2 mt-10 -129.64 79.94 1.93 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.856 0.36 . . . . 0.0 111.402 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.29 -63.11 2.96 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.363 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.1 36.49 0.53 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.833 -0.698 . . . . 0.0 111.786 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 10.0 t -157.87 141.94 15.91 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.702 ' H ' ' HA2' ' A' ' 448' ' ' GLY . 0.5 OUTLIER -104.7 145.93 29.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.879 -178.22 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.457 ' HA ' ' OE1' ' A' ' 444' ' ' GLU . 18.5 ptpt -163.52 159.46 22.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.987 0.422 . . . . 0.0 111.764 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 17.2 t0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.967 176.427 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.677 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.14 139.13 52.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.894 0.378 . . . . 0.0 111.526 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -161.06 130.93 4.92 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -68.31 -48.78 64.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.855 -174.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 8.3 t -156.69 -136.8 0.05 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -178.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp 57.42 37.48 27.91 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.109 0.481 . . . . 0.0 111.226 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 26.2 m -162.24 -46.75 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -163.5 -128.93 0.99 Allowed Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.47 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 4.6 p -156.41 120.73 2.37 Favored Pre-proline 0 C--N 1.317 -0.828 0 O-C-N 122.446 -0.443 . . . . 0.0 110.374 175.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 24.0 Cg_exo -64.58 99.99 0.32 Allowed 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.669 2.246 . . . . 0.0 111.239 -178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.64 111.14 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.826 -176.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.8 m 60.49 25.28 14.89 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.832 -175.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 65.11 -62.95 0.2 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.879 0.872 . . . . 0.0 111.875 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 13.1 m -80.99 122.66 27.55 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 177.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -74.19 138.61 43.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.787 0.327 . . . . 0.0 110.863 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 8.8 t -165.59 136.29 3.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.786 178.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 61.0 40.79 14.85 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.372 -176.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -171.86 42.15 0.18 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.641 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -84.14 -39.48 19.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.472 177.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -72.98 136.27 45.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.184 179.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 2.1 m -77.48 50.42 0.8 Allowed 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.965 -174.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.617 HG23 ' H ' ' A' ' 444' ' ' GLU . 7.4 t -97.72 -24.91 15.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.526 177.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 61.17 26.8 16.64 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.435 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.617 ' H ' HG23 ' A' ' 442' ' ' THR . 10.2 tt0 49.34 40.97 19.67 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.364 176.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -80.48 -24.43 39.48 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.769 -179.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.404 ' HB2' ' HA ' ' A' ' 467' ' ' LYS . 83.5 m -73.94 -35.46 64.57 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.372 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 444' ' ' GLU . 65.1 tttp -64.74 117.73 7.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 139.25 -35.97 1.91 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -175.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.78 137.75 54.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.131 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -80.76 -169.99 41.94 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 169.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -67.11 -34.89 78.58 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 117.108 0.454 . . . . 0.0 111.234 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.67 -38.92 53.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.118 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.44 -49.07 67.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.511 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 4.7 t -62.4 123.46 18.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.347 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 51.5 mttm -141.91 33.28 1.58 Allowed 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 122.023 0.916 . . . . 0.0 110.114 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.664 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 39.0 m 45.67 50.12 7.41 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 113.059 -1.882 . . . . 0.0 113.136 178.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' A' ' 456' ' ' SER . 5.2 Cg_exo -74.33 -44.75 0.39 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.902 1.735 . . . . 0.0 109.88 175.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.01 36.81 0.15 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 173.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 456' ' ' SER . 57.4 m -147.89 145.42 28.65 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.756 -171.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -114.41 136.47 52.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.747 0.308 . . . . 0.0 110.616 178.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 58.8 t-105 -80.94 118.63 22.59 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.791 ' HB3' ' HD2' ' A' ' 467' ' ' LYS . 34.2 tt0 -155.06 133.09 11.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.657 0.265 . . . . 0.0 110.724 -175.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.39 35.94 81.5 Favored Glycine 0 C--O 1.234 0.122 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.794 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 62.17 40.1 98.52 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.514 HG22 ' HG3' ' A' ' 467' ' ' LYS . 5.3 m -157.76 133.77 9.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.804 0.335 . . . . 0.0 110.529 -175.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . . . . . . . . . 11.9 t -86.62 119.41 26.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.791 ' HD2' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -157.85 155.12 29.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.752 -173.291 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.267 -0.873 . . . . 0.0 111.197 -176.493 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 7.0 m -65.42 -45.56 83.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.743 0.306 . . . . 0.0 110.374 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 39.2 tptt 69.82 -66.64 0.26 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.275 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.594 ' HA ' HG22 ' A' ' 434' ' ' THR . . . -95.94 118.94 33.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.638 0.256 . . . . 0.0 110.437 176.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 4.0 m -75.19 -40.68 59.16 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.397 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 426' ' ' LYS . 44.9 tptt 58.08 40.03 25.63 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.037 178.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.15 -36.63 40.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.592 178.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -173.9 -118.85 0.52 Allowed Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 110.701 -0.959 . . . . 0.0 110.701 -178.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 58.0 t -76.27 127.83 83.98 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -59.64 112.26 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.366 2.044 . . . . 0.0 112.126 -177.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.88 44.95 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.614 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 19.5 p 49.44 38.43 14.26 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.28 0.632 . . . . 0.0 111.891 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.56 -23.62 15.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.562 179.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . 0.594 HG22 ' HA ' ' A' ' 424' ' ' ALA . 4.7 p -63.11 -57.7 9.71 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.685 -179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 51.18 49.22 21.54 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.41 175.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 13.2 t -82.2 143.45 31.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.671 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -155.3 -47.21 0.08 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.763 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . 0.741 ' HA3' ' HB2' ' A' ' 443' ' ' ALA . . . -89.51 -38.75 6.52 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.336 178.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 70.76 -53.08 0.67 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.723 0.809 . . . . 0.0 112.38 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -69.79 128.48 36.54 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.416 ' O ' ' HB ' ' A' ' 442' ' ' THR . 54.2 m 70.03 -65.92 0.29 Allowed 'General case' 0 C--N 1.331 -0.231 0 O-C-N 123.907 0.754 . . . . 0.0 111.273 -179.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.433 ' CG2' ' HB2' ' A' ' 445' ' ' LYS . 12.3 t 176.54 -32.95 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.876 174.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . 0.741 ' HB2' ' HA3' ' A' ' 438' ' ' GLY . . . 70.12 -56.84 0.58 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.723 0.809 . . . . 0.0 111.706 -179.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.57 ' HG3' ' HD2' ' A' ' 447' ' ' LYS . 9.5 mp0 -78.63 37.64 0.29 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.909 0.385 . . . . 0.0 111.455 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.453 ' HD2' ' SG ' ' A' ' 459' ' ' CYS . 24.2 ttmt -73.48 -33.14 64.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.53 0.681 . . . . 0.0 109.578 174.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 65.1 m -132.64 1.82 3.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.301 -173.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.57 ' HD2' ' HG3' ' A' ' 444' ' ' GLU . 37.1 ttmt -62.64 120.83 11.94 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.277 -177.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 115.31 -17.43 16.67 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.292 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.636 ' HB3' ' HB3' ' A' ' 453' ' ' ASP . 42.6 mtmt -81.74 142.3 32.77 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.857 0.328 . . . . 0.0 110.825 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.61 167.15 50.74 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -56.95 -38.55 73.09 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -69.54 -31.09 69.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.774 0.321 . . . . 0.0 111.263 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.636 ' HB3' ' HB3' ' A' ' 449' ' ' LYS . 2.3 t0 -81.57 -38.67 25.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.0 109.519 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 49.6 t -60.61 145.73 47.89 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.559 174.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.484 ' HD2' ' O ' ' A' ' 453' ' ' ASP . 7.8 mptt -137.29 148.78 46.63 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.508 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 3.5 m -63.41 -47.51 83.73 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 456' ' ' SER . 37.7 Cg_endo -65.25 -29.38 55.2 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 121.029 1.152 . . . . 0.0 110.965 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.54 -48.36 22.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.41 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.453 ' SG ' ' HD2' ' A' ' 445' ' ' LYS . 36.4 m -158.06 -162.17 1.11 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.175 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -121.65 136.92 54.93 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.313 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.461 ' CE3' ' HB2' ' A' ' 466' ' ' CYS . 71.9 t-105 -103.18 124.75 49.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.6 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -135.5 110.88 9.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.761 0.315 . . . . 0.0 110.781 -178.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 70.09 -67.02 0.68 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.668 -0.696 . . . . 0.0 113.034 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -169.44 43.08 0.21 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 12.1 t -157.78 138.22 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.938 0.399 . . . . 0.0 110.032 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.461 ' HB2' ' CE3' ' A' ' 461' ' ' TRP . 14.7 t -106.86 130.51 54.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.212 -176.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -161.49 150.68 16.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.168 0.508 . . . . 0.0 112.025 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 37.3 t0 . . . . . 0 C--O 1.245 0.859 0 CA-C-O 118.07 -0.967 . . . . 0.0 109.382 179.595 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.876 0 N-CA-C 112.203 -0.359 . . . . 0.0 112.203 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 15.4 t -179.96 143.8 0.18 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt 62.46 37.88 13.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.26 0.553 . . . . 0.0 110.242 -177.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -90.2 141.89 28.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.637 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.9 t -77.08 93.06 3.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -78.64 49.94 0.93 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.076 -177.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 22.8 t -94.23 126.18 39.32 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.499 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 158.29 -51.28 0.4 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.455 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 7.5 p -163.95 125.87 1.55 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-O 121.207 0.527 . . . . 0.0 111.031 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 16.5 Cg_exo -67.37 131.15 24.07 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.666 2.244 . . . . 0.0 110.846 178.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 4.4 t -84.51 46.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.411 0.624 . . . . 0.0 109.7 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 3.2 p -86.89 128.54 35.06 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.831 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -97.19 130.56 44.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.394 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.1 t -78.59 -39.7 36.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.69 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -171.75 143.39 1.67 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.685 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 1.9 p -70.15 81.78 0.52 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.338 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 60.67 -143.87 0.5 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.392 -175.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -167.32 130.36 2.1 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.209 179.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -172.42 127.59 0.54 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -82.57 54.17 2.56 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.905 0.383 . . . . 0.0 110.094 178.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.0 t -65.79 135.1 54.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.905 -177.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.422 ' H ' ' H ' ' A' ' 443' ' ' ALA . 8.9 t -156.34 -19.87 0.1 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.232 -176.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . 0.422 ' H ' ' H ' ' A' ' 442' ' ' THR . . . 60.83 -153.16 0.38 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.435 -178.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 444' ' ' GLU . 33.0 tt0 -91.84 39.5 1.01 Allowed 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.538 0.685 . . . . 0.0 110.654 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -71.02 -37.97 72.61 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 172.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.629 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 36.4 m -151.07 10.76 0.61 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.006 178.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -73.29 132.24 42.87 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.314 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 70.49 34.42 67.95 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.898 -0.592 . . . . 0.0 113.758 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -88.39 -49.6 6.84 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.332 -0.511 . . . . 0.0 110.731 176.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 105.21 150.84 20.14 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -171.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.01 -41.78 92.88 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 117.108 0.454 . . . . 0.0 112.104 -171.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -68.06 -38.89 82.96 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.706 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.75 -43.41 65.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.946 0.403 . . . . 0.0 110.415 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 34.2 t -54.76 120.27 6.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.171 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 12.0 tptt -89.28 123.03 33.11 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.483 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.0 m -58.92 -50.87 85.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -174.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 456' ' ' SER . 25.2 Cg_endo -61.37 -30.88 88.12 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 121.61 1.54 . . . . 0.0 111.811 178.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.73 -46.18 22.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.371 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 468' ' ' ASP . 66.3 m -148.15 143.23 26.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.102 0.477 . . . . 0.0 110.808 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -79.32 159.16 27.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.69 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.644 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 39.2 t-105 -102.09 124.12 47.14 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.247 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -106.71 59.61 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.359 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.49 -55.04 4.08 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.604 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.8 31.41 0.61 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.308 -0.717 . . . . 0.0 111.308 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 40.2 m -143.17 129.09 19.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.507 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.644 ' HB2' ' HZ3' ' A' ' 461' ' ' TRP . 46.9 t -91.81 117.08 29.44 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.08 134.61 1.6 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.569 ' HB2' ' HA ' ' A' ' 459' ' ' CYS . 32.0 t70 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.362 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . 0.463 ' HB ' ' H ' ' A' ' 423' ' ' LYS . 1.0 OUTLIER -87.32 -145.6 0.13 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.636 0.255 . . . . 0.0 111.37 179.184 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . 0.463 ' H ' ' HB ' ' A' ' 422' ' ' THR . 21.9 pttp -69.84 -33.92 72.94 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.732 0.301 . . . . 0.0 111.132 -178.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.447 ' HB2' HG12 ' A' ' 429' ' ' VAL . . . -148.34 127.18 12.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.08 -178.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 20.1 m -93.41 41.96 1.09 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.312 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 20.7 tptm 67.45 118.13 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.767 0.827 . . . . 0.0 111.643 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 14.4 p 49.83 47.17 23.43 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.795 -179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 172.77 132.46 1.52 Allowed Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 111.314 -0.714 . . . . 0.0 111.314 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.651 ' HB ' HG13 ' A' ' 431' ' ' VAL . 13.4 m -131.72 125.55 20.49 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-O 121.147 0.499 . . . . 0.0 111.971 -177.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -88.73 45.07 0.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.374 2.716 . . . . 0.0 111.23 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.651 HG13 ' HB ' ' A' ' 429' ' ' VAL . 31.3 m -83.3 -7.56 10.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.13 -173.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . 0.492 HG22 ' HG3' ' A' ' 433' ' ' GLN . 33.1 m 70.06 -68.08 0.21 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.145 178.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.492 ' HG3' HG22 ' A' ' 432' ' ' THR . 87.1 mt-30 -143.89 -48.56 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.328 0.109 . . . . 0.0 111.023 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . 0.656 HG22 ' HB2' ' A' ' 437' ' ' ALA . 23.7 m 62.21 55.21 2.46 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.701 0.762 . . . . 0.0 110.795 -177.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -84.89 144.06 28.62 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.507 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . 0.592 ' HB ' ' HA ' ' A' ' 440' ' ' ASP . 3.3 p 49.93 54.26 11.38 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.552 0.691 . . . . 0.0 111.09 -173.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . 0.656 ' HB2' HG22 ' A' ' 434' ' ' THR . . . -63.71 -47.89 79.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.57 -173.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -62.4 -41.06 99.78 Favored Glycine 0 C--O 1.235 0.189 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.083 -178.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -164.91 126.05 2.05 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 177.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . 0.592 ' HA ' ' HB ' ' A' ' 436' ' ' THR . 19.3 m-20 -72.4 125.63 27.87 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.014 -179.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 3.8 p -72.62 -40.11 66.73 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.064 0.459 . . . . 0.0 110.075 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.52 ' HB ' ' CD ' ' A' ' 445' ' ' LYS . 54.7 m -80.38 124.63 29.04 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.769 175.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -78.88 -49.48 12.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.276 0.56 . . . . 0.0 110.048 176.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -83.27 72.54 10.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.871 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.765 ' HE2' ' HB3' ' A' ' 468' ' ' ASP . 14.3 mmmm -73.86 53.94 0.48 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.158 177.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.46 ' SG ' ' HD3' ' A' ' 449' ' ' LYS . 11.8 t 74.29 16.21 3.43 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 122.09 0.948 . . . . 0.0 109.36 -173.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 89.2 tttt -70.6 126.23 29.04 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.146 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 131.97 -30.56 3.19 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.193 -178.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.46 ' HD3' ' SG ' ' A' ' 446' ' ' CYS . 30.9 mtpp -76.07 137.47 40.2 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.257 0.551 . . . . 0.0 111.123 -177.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -78.48 162.25 49.14 Favored Glycine 0 C--O 1.22 -0.728 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.372 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.86 -35.32 76.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.718 0.759 . . . . 0.0 110.648 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -84.16 40.52 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.305 0.574 . . . . 0.0 110.316 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -164.09 -50.39 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.867 -177.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.86 132.83 40.59 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 21.5 tptm -144.61 45.95 1.38 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.789 0.804 . . . . 0.0 110.779 -171.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.668 ' HA ' ' O ' ' A' ' 459' ' ' CYS . 20.3 m 44.25 44.47 1.55 Allowed Pre-proline 0 C--N 1.314 -0.95 0 CA-C-N 114.084 -1.416 . . . . 0.0 114.266 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.596 ' HD3' ' N ' ' A' ' 456' ' ' SER . 4.5 Cg_endo -82.05 -48.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.921 1.747 . . . . 0.0 110.326 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.425 ' H ' ' HD2' ' A' ' 457' ' ' PRO . 8.5 t70 -148.25 37.9 0.86 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 173.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.668 ' O ' ' HA ' ' A' ' 456' ' ' SER . 4.0 m -148.64 132.66 17.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.85 -172.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.33 136.58 45.81 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.189 177.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.458 ' HE3' ' SG ' ' A' ' 466' ' ' CYS . 32.2 t-105 -85.93 126.45 34.11 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.031 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.59 121.33 9.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.761 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 55.53 45.75 83.34 Favored Glycine 0 N--CA 1.453 -0.191 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.999 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.78 35.94 92.0 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.589 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 60.9 m -155.17 134.22 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.552 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -85.52 130.63 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.018 178.686 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 445' ' ' LYS . 20.7 pttp -168.28 133.8 1.82 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.765 ' HB3' ' HE2' ' A' ' 445' ' ' LYS . 60.4 t0 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.964 -0.541 . . . . 0.0 109.773 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 111.79 -0.524 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 28.5 m -67.12 115.37 6.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.785 0.326 . . . . 0.0 111.143 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -78.86 -47.08 17.26 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 58.43 -155.18 0.35 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.657 178.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 13.3 m 64.03 176.84 0.17 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.162 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . 0.532 ' NZ ' ' HB3' ' A' ' 426' ' ' LYS . 8.1 mtpm? -82.88 46.1 1.06 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.129 0.49 . . . . 0.0 110.094 176.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 11.2 m -69.67 131.88 45.3 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.37 -176.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -83.98 -147.64 8.15 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.749 -0.739 . . . . 0.0 111.662 176.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 10.4 t -94.76 117.45 66.91 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.767 ' HG2' ' HE3' ' A' ' 449' ' ' LYS . 57.1 Cg_endo -76.18 59.22 5.9 Favored 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.859 2.373 . . . . 0.0 113.278 -175.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 3.2 t -81.19 49.9 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 33.6 m 66.86 -75.05 0.06 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.768 -173.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 52.28 -155.59 0.17 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.371 0.668 . . . . 0.0 112.593 172.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 2.7 m -66.48 -42.67 87.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.038 -176.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -57.79 -29.36 64.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.128 -179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 3.5 m 64.35 51.36 2.09 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -176.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -68.68 69.8 0.17 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.181 -174.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . 0.602 ' HA3' ' HA ' ' A' ' 445' ' ' LYS . . . 177.72 36.89 0.06 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 178.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -92.99 34.76 1.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.944 0.402 . . . . 0.0 111.076 -179.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -74.63 156.12 37.08 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 13.1 t -61.95 -24.06 66.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.258 0.551 . . . . 0.0 110.316 178.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.829 HG22 ' HG2' ' A' ' 444' ' ' GLU . 25.7 m -71.39 -11.54 60.94 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.059 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 74.91 -32.87 0.23 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.856 0.862 . . . . 0.0 112.317 179.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.829 ' HG2' HG22 ' A' ' 442' ' ' THR . 13.5 mm-40 -59.4 116.87 4.24 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.924 0.392 . . . . 0.0 110.339 -174.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.602 ' HA ' ' HA3' ' A' ' 438' ' ' GLY . 52.0 mtmt -71.29 -31.17 67.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.654 -179.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.685 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 34.3 m -72.26 -32.71 66.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.247 -178.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 83.1 tttt -56.51 133.33 53.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.628 -177.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 102.18 -28.59 15.25 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.746 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.767 ' HE3' ' HG2' ' A' ' 430' ' ' PRO . 62.6 mtpt -65.1 144.15 57.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.004 0.43 . . . . 0.0 111.71 -177.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 162.61 54.72 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.457 178.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -59.78 -42.92 94.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.299 0.549 . . . . 0.0 111.051 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -65.83 -36.39 83.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.782 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -75.15 -45.62 39.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.743 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 51.0 t -56.68 119.07 5.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.282 -178.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -81.04 109.44 15.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.526 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 6.6 m -59.97 -48.66 94.16 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -171.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.0 Cg_endo -58.28 -38.74 89.53 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 121.175 1.25 . . . . 0.0 111.356 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -77.16 -47.99 18.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.4 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.62 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 16.5 m -127.06 132.6 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -79.99 130.82 35.57 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.941 0.401 . . . . 0.0 110.913 -176.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -82.3 122.46 27.98 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -166.44 137.65 3.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.718 0.294 . . . . 0.0 110.485 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 69.77 37.03 75.61 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.453 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 58.12 34.6 73.74 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.393 -0.432 . . . . 0.0 112.773 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 6.1 t -167.68 157.6 10.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.014 0.435 . . . . 0.0 110.119 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.685 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 14.4 t -82.36 120.8 25.89 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.469 -176.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 459' ' ' CYS . 74.1 mmtt -90.73 146.51 23.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.751 0.31 . . . . 0.0 111.066 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 444' ' ' GLU . 40.3 t0 . . . . . 0 C--O 1.246 0.92 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.033 0 N-CA-C 112.121 -0.392 . . . . 0.0 112.121 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 22.0 m -66.0 128.23 35.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.533 0.206 . . . . 0.0 110.52 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . 0.816 ' HA ' ' HE2' ' A' ' 423' ' ' LYS . 0.5 OUTLIER -69.09 -40.83 78.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.624 0.249 . . . . 0.0 110.776 -178.511 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 63.76 -148.29 0.31 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.282 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 19.1 m 56.35 40.64 29.71 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 121.372 0.606 . . . . 0.0 110.168 -176.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -76.11 133.38 40.29 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.356 -177.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 15.3 m 58.89 35.41 24.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.967 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 174.75 44.5 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.874 -178.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.486 HG13 ' HA ' ' A' ' 432' ' ' THR . 8.5 p -69.4 131.79 89.96 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 176.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.12 -52.42 7.93 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.719 2.279 . . . . 0.0 112.057 -176.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 20.5 t -84.31 63.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.221 0.534 . . . . 0.0 109.77 174.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . 0.486 ' HA ' HG13 ' A' ' 429' ' ' VAL . 9.9 t -70.86 -34.08 71.27 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.853 -175.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.472 ' HG3' HG23 ' A' ' 432' ' ' THR . 25.2 mt-30 -101.6 150.87 22.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.952 178.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 18.4 p -79.95 142.77 34.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.571 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.12 -37.66 86.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.017 0.437 . . . . 0.0 110.498 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 25.4 m -86.78 139.05 31.09 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.908 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 65.59 41.4 4.1 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.528 0.517 . . . . 0.0 110.663 -176.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . 0.41 ' C ' ' H ' ' A' ' 440' ' ' ASP . . . -83.53 -45.66 6.38 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.823 178.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . 0.723 ' HA ' ' HB2' ' A' ' 443' ' ' ALA . . . 70.87 -32.86 0.25 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.573 0.749 . . . . 0.0 112.665 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 438' ' ' GLY . 51.7 m-20 -58.41 137.67 57.12 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 122.235 0.214 . . . . 0.0 111.032 -178.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 1.7 m 61.25 38.42 16.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.104 -178.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 28.0 m 69.03 128.2 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.388 -178.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . 0.723 ' HB2' ' HA ' ' A' ' 439' ' ' ALA . . . -82.32 47.22 1.12 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.31 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 55.73 55.56 7.01 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.632 177.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -74.83 -44.04 51.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.477 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 73.0 m -80.23 -44.44 19.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.567 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 58.2 tptt -60.33 113.66 2.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.727 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 127.01 -25.56 5.22 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.602 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.516 ' HE3' ' OD2' ' A' ' 453' ' ' ASP . 55.3 mtpt -75.45 141.28 43.17 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 120.933 0.397 . . . . 0.0 111.032 -177.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -75.31 158.2 50.45 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.961 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . 0.538 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 38.9 tt0 -60.25 -36.9 78.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.962 0.381 . . . . 0.0 111.346 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -83.8 37.83 0.61 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.223 0.535 . . . . 0.0 110.844 178.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.516 ' OD2' ' HE3' ' A' ' 449' ' ' LYS . 29.4 t70 -163.52 -50.13 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.909 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 1.7 t -68.12 125.67 27.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.461 176.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 41.6 mmtm -92.26 135.64 33.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -178.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.502 ' HB3' ' HD3' ' A' ' 457' ' ' PRO . 23.1 t -60.56 -50.0 87.47 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.502 ' HD3' ' HB3' ' A' ' 456' ' ' SER . 26.7 Cg_exo -62.42 -29.12 78.79 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.632 1.554 . . . . 0.0 111.504 178.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.458 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 38.0 t70 -80.8 -42.32 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.241 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.84 134.47 24.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -66.23 115.87 6.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.941 0.401 . . . . 0.0 111.23 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.538 ' CZ2' ' HB2' ' A' ' 451' ' ' GLU . 48.9 t-105 -85.44 119.38 25.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 172.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -154.58 126.03 7.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.695 0.283 . . . . 0.0 110.734 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.58 33.08 75.74 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.082 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.43 39.21 97.48 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 121.188 -0.53 . . . . 0.0 112.37 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 8.8 t -165.9 145.16 6.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 0.1 OUTLIER -86.21 135.51 33.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 -175.571 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -130.88 139.72 50.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.009 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 33.4 t70 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.785 -0.626 . . . . 0.0 109.991 178.778 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.08 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 9.8 t 44.23 -128.88 0.93 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.746 0.818 . . . . 0.0 111.122 -176.783 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -63.56 132.36 50.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 118.076 0.398 . . . . 0.0 110.393 179.104 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 73.41 137.43 0.05 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 124.055 0.847 . . . . 0.0 111.002 -174.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.4 t -64.7 -44.15 91.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.768 -176.237 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.6 136.89 19.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 0.0 110.239 177.123 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 11.6 p -158.62 40.73 0.24 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.716 -176.093 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -71.75 135.8 23.68 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.753 177.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 5.4 p -137.07 131.4 17.81 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -178.733 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.62 -55.13 2.26 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.596 2.198 . . . . 0.0 112.974 -174.444 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 12.2 t 57.55 42.82 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-O 121.927 0.87 . . . . 0.0 109.68 -177.143 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.9 p -92.59 44.54 1.16 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.562 -176.469 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -87.0 130.13 34.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.352 177.943 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 5.8 t -164.76 123.53 1.78 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.11 0.481 . . . . 0.0 110.854 -179.676 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -149.72 133.87 17.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.476 179.282 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.9 m -70.99 120.34 16.42 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.12 -52.06 57.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.557 -174.201 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -170.09 59.08 0.19 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.319 -179.356 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -162.53 36.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.097 0.475 . . . . 0.0 110.883 -178.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -82.04 113.81 20.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.312 177.695 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 89.0 m 69.42 -57.07 0.54 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.515 -175.047 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 9.3 t -175.29 153.98 1.64 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -178.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -61.6 117.79 6.22 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 177.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.942 ' HG3' ' HB3' ' A' ' 447' ' ' LYS . 30.8 tt0 -74.06 115.0 13.03 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.153 0.501 . . . . 0.0 111.317 -176.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.511 ' HB3' ' OD2' ' A' ' 468' ' ' ASP . 6.2 ttpm? -137.32 -44.56 0.55 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.107 -0.952 . . . . 0.0 108.516 176.725 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.558 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 46.0 m -87.4 -30.81 20.45 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.66 -1.155 . . . . 0.0 110.753 175.762 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.942 ' HB3' ' HG3' ' A' ' 444' ' ' GLU . 62.8 tttm -62.46 133.5 55.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.372 -175.414 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.93 53.87 6.08 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.288 176.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.822 ' HE2' ' HB3' ' A' ' 453' ' ' ASP . 49.9 mtpt -122.17 -50.71 2.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.994 0.426 . . . . 0.0 111.44 178.238 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 126.53 156.01 9.08 Favored Glycine 0 N--CA 1.444 -0.803 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -172.003 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -61.84 -41.97 98.46 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.323 0.562 . . . . 0.0 111.392 -173.369 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.6 pttm -71.95 -34.78 69.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.624 179.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.822 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -75.51 -40.19 57.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.388 -179.033 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.8 t -59.9 118.62 6.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.176 179.025 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -74.72 123.25 24.58 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.235 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.457 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 46.0 m -71.13 -51.57 10.28 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -173.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 456' ' ' SER . 28.6 Cg_endo -63.61 -27.33 69.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.512 1.475 . . . . 0.0 111.871 -179.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -97.39 -33.17 11.51 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.479 -174.278 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.2 m -129.98 150.27 51.34 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 122.127 -0.358 . . . . 0.0 110.974 -172.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.479 ' HB2' ' HG2' ' A' ' 467' ' ' LYS . 63.5 mttm -86.87 139.11 30.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.33 -179.119 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.476 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.2 t-105 -111.78 122.74 48.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.523 ' HB3' ' HE3' ' A' ' 467' ' ' LYS . 69.4 tt0 -158.58 134.54 9.04 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.513 0.196 . . . . 0.0 110.866 -175.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 65.35 31.63 81.05 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.354 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.53 37.83 94.94 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.171 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.8 t -165.35 146.91 7.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.097 0.475 . . . . 0.0 110.711 179.398 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.7 t -87.11 147.49 25.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.094 -175.22 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.523 ' HE3' ' HB3' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.71 142.72 27.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.973 0.416 . . . . 0.0 110.456 178.565 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.511 ' OD2' ' HB3' ' A' ' 445' ' ' LYS . 2.6 m-20 . . . . . 0 C--O 1.254 1.317 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.356 -179.128 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.836 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 15.0 m -71.95 120.0 16.93 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.968 0.413 . . . . 0.0 111.022 -178.383 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -82.24 -42.02 19.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.505 177.023 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 68.36 -78.16 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 O-C-N 124.239 0.962 . . . . 0.0 110.871 -177.44 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.6 t -88.62 143.13 27.15 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 176.038 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -156.02 157.36 36.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.713 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.6 m 73.42 -47.32 0.66 Allowed 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.792 0.683 . . . . 0.0 111.571 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 179.5 162.03 27.91 Favored Glycine 0 N--CA 1.442 -0.94 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.715 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 431' ' ' VAL . 58.5 t -58.87 132.59 86.69 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.64 0.22 . . . . 0.0 110.535 179.165 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -70.8 38.59 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.983 2.455 . . . . 0.0 113.057 -177.119 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.405 ' H ' ' C ' ' A' ' 429' ' ' VAL . 7.7 p -83.74 63.22 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.951 0.882 . . . . 0.0 110.027 175.497 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 2.5 m -74.63 56.27 0.69 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.134 -176.449 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -158.36 48.33 0.36 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -177.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 66.6 p 53.64 -154.56 0.24 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.963 -175.534 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -148.8 143.57 26.43 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 -177.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 9.1 m -100.6 -54.04 2.94 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.463 -179.454 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 176.68 -54.48 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.139 176.681 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -162.1 30.71 0.3 Allowed Glycine 0 N--CA 1.451 -0.305 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 179.025 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -164.25 43.46 0.1 Allowed 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 178.866 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.83 -37.78 88.65 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.149 -173.615 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.1 p -76.51 39.23 0.2 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.376 -179.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 21.4 m -65.18 -62.56 1.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.06 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . 0.498 ' HB3' ' OD2' ' A' ' 468' ' ' ASP . . . 170.22 -42.28 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.304 175.292 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.663 ' HG2' ' HB3' ' A' ' 447' ' ' LYS . 22.3 mt-10 61.52 40.93 13.14 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.813 -175.47 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.567 ' HB3' ' OD1' ' A' ' 468' ' ' ASP . 6.3 ttpm? -66.17 -45.72 79.9 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.933 172.628 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 10.7 t -98.34 -41.03 8.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.554 177.262 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.663 ' HB3' ' HG2' ' A' ' 444' ' ' GLU . 26.5 ttpp -58.62 125.2 22.44 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.349 -175.048 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.1 -20.52 4.49 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.255 -176.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.874 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 29.7 mtpt -93.45 -152.74 0.34 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.224 -178.113 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -127.83 160.94 21.82 Favored Glycine 0 C--O 1.219 -0.794 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.654 177.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -42.6 -43.08 3.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -174.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -64.0 -42.9 97.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.232 -178.66 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.755 ' HB3' ' HE2' ' A' ' 449' ' ' LYS . 46.6 m-20 -73.11 -51.08 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.658 0.742 . . . . 0.0 109.6 175.247 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.874 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 77.5 m -72.6 53.83 0.32 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 124.907 1.283 . . . . 0.0 111.472 177.391 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.656 ' HE2' ' HG2' ' A' ' 457' ' ' PRO . 20.6 ptmt -63.12 141.95 58.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.556 -177.357 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.519 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 7.3 t -50.4 -48.54 80.85 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.568 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.656 ' HG2' ' HE2' ' A' ' 455' ' ' LYS . 13.5 Cg_endo -57.63 -37.38 97.09 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 121.769 1.646 . . . . 0.0 112.621 -179.367 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -85.42 -36.82 20.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 456' ' ' SER . 82.0 m -138.54 135.54 35.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.006 -173.026 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.71 ' HB3' ' HB2' ' A' ' 467' ' ' LYS . 83.1 tttt -72.19 143.79 48.76 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 175.076 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.677 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 44.2 t-105 -116.49 126.68 53.7 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.08 -176.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.693 ' HB2' ' HD3' ' A' ' 467' ' ' LYS . 41.9 tt0 -95.99 -65.64 0.96 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 0.0 110.896 -179.11 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -179.24 87.34 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 68.56 31.65 73.94 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.744 -175.861 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.4 t -166.2 130.17 2.13 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -179.599 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.677 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 1.7 m -77.99 140.73 39.21 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.098 -177.233 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.71 ' HB2' ' HB3' ' A' ' 460' ' ' LYS . 27.1 mmmt -93.72 171.32 8.96 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.465 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.567 ' OD1' ' HB3' ' A' ' 445' ' ' LYS . 31.4 t70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.802 -169.6 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.741 0 N-CA-C 111.957 -0.457 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . 0.456 ' HB ' ' HD3' ' A' ' 426' ' ' LYS . 4.7 m -62.08 -48.94 77.95 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.685 0.243 . . . . 0.0 110.931 -178.618 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp 55.97 -135.42 1.29 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.77 179.73 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 55.58 41.94 30.14 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 122.583 0.353 . . . . 0.0 111.417 178.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 37.4 m 61.04 71.53 0.56 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.341 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . 0.456 ' HD3' ' HB ' ' A' ' 422' ' ' THR . 14.0 mmmm -52.49 127.31 22.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.81 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 6.1 p -172.85 -41.41 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.934 -178.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 77.74 -59.33 3.8 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.4 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.446 HG22 HG12 ' A' ' 431' ' ' VAL . 8.0 p 34.72 65.02 1.69 Allowed Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 123.962 0.905 . . . . 0.0 112.094 178.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -76.78 43.8 1.32 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.608 2.205 . . . . 0.0 112.742 -177.026 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.446 HG12 HG22 ' A' ' 429' ' ' VAL . 7.3 p -71.83 121.82 22.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 176.884 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . 0.63 HG22 ' HB3' ' A' ' 435' ' ' GLN . 2.2 m -157.9 49.56 0.41 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.233 0.539 . . . . 0.0 109.956 -173.761 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -74.86 -40.87 60.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.794 -179.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 3.7 p -84.35 43.62 0.97 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.885 176.227 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . 0.63 ' HB3' HG22 ' A' ' 432' ' ' THR . 20.2 pt20 -70.18 137.8 51.28 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.065 -177.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 14.5 t -175.17 147.19 0.89 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.629 179.573 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -77.56 -155.5 0.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.823 0.344 . . . . 0.0 110.825 -178.545 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 179.3 -129.9 1.44 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 111.572 -0.611 . . . . 0.0 111.572 179.47 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 59.25 55.66 4.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.977 0.418 . . . . 0.0 110.662 179.544 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -155.32 116.61 3.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.781 -178.652 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 1.8 p -106.72 -26.94 11.09 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.032 -177.493 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.614 HG23 ' HB2' ' A' ' 468' ' ' ASP . 34.8 m -63.03 -53.16 58.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.338 -178.792 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 66.94 -11.41 0.26 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.179 0.591 . . . . 0.0 112.366 -179.43 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.565 ' H ' HG22 ' A' ' 442' ' ' THR . 86.3 mt-10 58.61 44.83 16.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.232 0.539 . . . . 0.0 110.868 -177.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.421 ' HE3' ' SG ' ' A' ' 446' ' ' CYS . 2.5 tmmm? -69.52 -39.34 77.6 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 174.226 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.841 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 21.4 m -117.38 -27.98 6.24 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.754 179.119 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.641 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 64.2 tttp -54.57 110.57 0.65 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.754 -176.189 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 112.55 -19.35 21.85 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.747 -0.74 . . . . 0.0 113.096 -178.533 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.834 ' HE3' ' HB3' ' A' ' 453' ' ' ASP . 31.1 mmmt -68.86 142.8 54.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 117.01 0.405 . . . . 0.0 111.335 -178.152 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -68.2 163.32 48.5 Favored Glycine 0 C--O 1.224 -0.502 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 175.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -55.01 -45.09 75.06 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -175.458 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -65.37 -44.84 86.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.898 0.38 . . . . 0.0 110.595 -179.008 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.834 ' HB3' ' HE3' ' A' ' 449' ' ' LYS . 0.9 OUTLIER -67.13 -44.75 79.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.157 179.226 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 33.4 t -64.88 122.12 16.22 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.49 -175.441 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 68.4 mttm -76.27 122.53 24.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.701 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.503 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 19.4 m -68.39 -50.31 28.4 Favored Pre-proline 0 C--N 1.322 -0.589 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -174.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 21.3 Cg_exo -65.01 -37.58 32.61 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 121.247 1.298 . . . . 0.0 110.974 179.076 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 7.7 t70 -71.28 -39.54 71.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.368 -179.127 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 54.6 m -138.65 140.34 38.83 Favored 'General case' 0 N--CA 1.458 -0.053 0 CA-C-O 121.24 0.543 . . . . 0.0 112.091 -174.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 467' ' ' LYS . 62.0 tttp -71.17 135.62 47.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.739 -178.17 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.625 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 65.4 t-105 -100.77 107.89 19.57 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 174.354 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.493 ' HB2' ' CD ' ' A' ' 467' ' ' LYS . 22.8 tt0 -82.7 50.8 1.75 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.019 0.437 . . . . 0.0 110.875 -177.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 54.61 31.68 53.0 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.699 -0.682 . . . . 0.0 113.755 177.931 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 161.45 -40.57 0.4 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.8 179.064 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.7 t -115.37 134.56 54.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.247 0.546 . . . . 0.0 110.812 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.841 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 47.4 t -81.95 140.24 34.13 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.633 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.493 ' CD ' ' HB2' ' A' ' 462' ' ' GLU . 0.0 OUTLIER -147.34 147.21 30.1 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.417 0.627 . . . . 0.0 111.192 -174.352 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.614 ' HB2' HG23 ' A' ' 442' ' ' THR . 19.9 m-20 . . . . . 0 C--N 1.316 -0.88 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.94 -179.473 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.746 0 N-CA-C 112.17 -0.372 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 6.7 t -75.78 140.87 42.59 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 120.885 0.374 . . . . 0.0 110.038 178.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -86.83 72.91 10.07 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.709 -178.084 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 72.14 -53.68 0.69 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.582 -177.168 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 69.6 m -155.27 110.95 3.09 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.588 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 99.8 mttt 55.27 -145.96 0.6 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.127 -176.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 3.4 p -83.66 61.03 6.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.875 0.369 . . . . 0.0 111.388 179.252 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -64.25 125.14 31.31 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.069 -179.827 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 20.4 t 55.45 69.7 1.86 Allowed Pre-proline 0 C--O 1.235 0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 110.484 -177.355 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.08 121.88 9.11 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.39 2.06 . . . . 0.0 112.019 -177.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 435' ' ' GLN . 7.4 p -70.19 128.61 33.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.158 178.002 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 19.0 p -138.05 47.6 2.01 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.438 -176.099 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 73.07 139.33 0.06 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.404 -176.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 67.9 p 50.17 49.11 21.07 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.688 -175.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 431' ' ' VAL . 45.1 tp60 70.44 -81.25 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.807 -172.139 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 15.3 t 179.11 133.19 0.09 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.04 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 57.46 -136.4 1.03 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.586 -175.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -169.04 133.44 2.86 Favored Glycine 0 N--CA 1.443 -0.857 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 179.198 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 56.99 59.23 3.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.866 0.365 . . . . 0.0 110.614 -178.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . 0.573 ' O ' ' HB ' ' A' ' 441' ' ' THR . 12.7 p-10 -58.62 117.22 4.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.551 -177.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.772 HG23 HG22 ' A' ' 442' ' ' THR . 14.9 t 165.42 -28.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.953 -177.776 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.772 HG22 HG23 ' A' ' 441' ' ' THR . 3.2 t -161.37 136.43 7.48 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.451 177.177 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -64.21 -57.01 10.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.911 -173.537 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.515 ' HG2' ' H ' ' A' ' 447' ' ' LYS . 0.0 OUTLIER -117.15 16.26 14.95 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.471 0.653 . . . . 0.0 111.356 -175.871 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.463 ' HA ' ' CG2' ' A' ' 442' ' ' THR . 24.1 mtmm 62.8 31.63 16.37 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.654 -1.157 . . . . 0.0 109.665 -177.377 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.621 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 75.0 m 69.69 13.29 8.16 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 113.93 -1.486 . . . . 0.0 111.849 176.805 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.515 ' H ' ' HG2' ' A' ' 444' ' ' GLU . 40.8 ttmt -57.67 117.92 4.72 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.011 -176.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 56.35 46.32 87.11 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.308 -0.86 . . . . 0.0 113.822 173.842 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.594 ' HD2' ' HA ' ' A' ' 454' ' ' CYS . 12.4 ptpt -90.89 -41.37 11.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 117.203 0.501 . . . . 0.0 111.849 -179.65 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 123.91 151.68 8.24 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.999 -178.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 453' ' ' ASP . 6.4 tm-20 -66.28 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.563 0.181 . . . . 0.0 111.033 -176.049 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -79.15 38.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.175 0.512 . . . . 0.0 110.52 177.676 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 451' ' ' GLU . 50.6 t0 -166.22 -43.85 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.496 -178.93 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.594 ' HA ' ' HD2' ' A' ' 449' ' ' LYS . 53.7 t -64.16 112.15 2.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.242 -176.072 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.435 ' O ' ' HD3' ' A' ' 455' ' ' LYS . 0.0 OUTLIER -170.65 138.24 1.42 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.432 168.911 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 458' ' ' ASP . 12.2 t 170.04 142.15 0.08 OUTLIER Pre-proline 0 C--N 1.315 -0.928 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.2 -176.254 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.77 8.27 1.04 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 121.603 1.535 . . . . 0.0 110.008 172.753 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.495 ' H ' ' C ' ' A' ' 456' ' ' SER . 87.8 m-20 -115.17 -52.17 2.69 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.992 177.972 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 63.8 m -82.44 131.59 35.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.691 179.74 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -111.48 141.71 44.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.256 -178.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -85.87 123.51 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.699 176.218 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -103.87 55.83 0.73 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.855 0.36 . . . . 0.0 110.711 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.62 -52.16 3.11 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.199 -0.524 . . . . 0.0 113.359 179.166 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -152.2 33.88 0.85 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.09 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 9.5 t -171.4 134.08 0.86 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.621 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 10.8 t -91.98 140.66 29.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.286 -0.416 . . . . 0.0 109.911 -176.848 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -168.21 136.56 2.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.159 0.504 . . . . 0.0 111.414 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 56.8 t0 . . . . . 0 C--O 1.248 1.014 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.323 175.674 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.757 0 N-CA-C 111.941 -0.463 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 11.7 t -84.57 -36.11 22.32 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.884 0.373 . . . . 0.0 110.758 -179.311 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . 0.438 ' HA ' ' HG3' ' A' ' 426' ' ' LYS . 14.3 ttpp -84.97 53.55 2.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.156 0.503 . . . . 0.0 110.941 179.996 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -100.9 123.14 44.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.686 179.116 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 18.3 t 58.68 39.07 24.86 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.569 0.543 . . . . 0.0 110.937 179.521 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . 0.438 ' HG3' ' HA ' ' A' ' 423' ' ' LYS . 30.3 mmmt -88.0 -31.74 19.19 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 178.516 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 32.6 t 71.72 145.42 0.07 Allowed 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.661 0.601 . . . . 0.0 110.662 -178.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -65.62 -58.93 8.31 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.691 -175.367 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 85.0 t -144.23 121.21 6.49 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-O 120.546 0.212 . . . . 0.0 110.521 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.53 128.32 16.06 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.379 2.053 . . . . 0.0 110.957 175.882 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 20.8 m -61.5 127.9 22.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.487 0.661 . . . . 0.0 111.85 -174.808 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 1.3 p -87.27 -45.13 10.89 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.404 178.178 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -135.43 -142.3 0.18 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.825 178.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 24.9 m -80.33 131.57 35.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.757 0.313 . . . . 0.0 110.462 178.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -68.27 159.64 30.87 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.7 -177.74 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 2.1 p -55.67 135.98 50.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.995 -178.62 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -73.66 -47.6 38.6 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.397 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -178.8 -53.84 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.293 179.052 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -130.04 122.24 28.0 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 176.293 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -72.03 128.35 35.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.364 -175.144 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 5.6 t -168.2 120.21 0.84 Allowed 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.402 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 48.6 m 69.13 -65.96 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.887 -179.786 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -178.35 -45.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 176.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 445' ' ' LYS . 40.3 tt0 -155.54 45.22 0.47 Allowed 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 114.782 -1.099 . . . . 0.0 108.126 176.407 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.718 ' O ' ' HB2' ' A' ' 446' ' ' CYS . 60.7 mttp 73.63 -53.8 0.69 Allowed 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 114.165 -1.38 . . . . 0.0 110.425 -172.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.718 ' HB2' ' O ' ' A' ' 445' ' ' LYS . 6.4 t 157.37 7.51 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 O-C-N 124.695 1.247 . . . . 0.0 109.341 175.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.411 ' H ' ' H ' ' A' ' 446' ' ' CYS . 24.3 ttpp -63.37 132.12 50.48 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.436 -175.111 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 138.56 -39.26 1.59 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.87 143.64 56.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.388 -0.406 . . . . 0.0 110.751 179.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.73 166.0 49.74 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 175.2 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . 0.6 ' HG2' ' H ' ' A' ' 452' ' ' LYS . 12.3 pm0 -55.07 -56.76 16.22 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.6 ' H ' ' HG2' ' A' ' 451' ' ' GLU . 1.3 mptm? -71.23 -37.11 72.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.853 0.358 . . . . 0.0 110.638 177.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -63.6 -34.06 76.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.86 -178.152 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.0 115.64 3.0 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.248 176.166 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -84.48 128.23 34.47 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -177.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.611 ' HB2' ' HD3' ' A' ' 457' ' ' PRO . 1.9 m -60.27 -54.53 54.24 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -171.909 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' A' ' 456' ' ' SER . 46.6 Cg_exo -57.77 -33.31 96.68 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.733 1.622 . . . . 0.0 111.538 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -77.08 -49.16 15.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.439 178.215 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 25.2 m -151.69 136.36 17.07 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.411 -174.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -86.16 141.05 29.64 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.102 -0.374 . . . . 0.0 110.175 176.531 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -87.43 118.23 26.75 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.265 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.517 ' HB2' ' HE3' ' A' ' 467' ' ' LYS . 81.3 mt-10 -149.63 132.29 15.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.721 0.296 . . . . 0.0 110.998 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 59.17 38.01 92.53 Favored Glycine 0 N--CA 1.452 -0.245 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.517 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 61.81 38.54 96.12 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.145 -178.561 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 88.4 m -150.94 128.43 11.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.883 0.373 . . . . 0.0 110.945 -176.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 5.9 t -78.06 126.7 31.2 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.951 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.517 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 22.0 pttp -166.4 149.37 7.03 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.712 -175.549 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 10.9 t70 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.258 -0.877 . . . . 0.0 109.434 174.753 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.859 0 N-CA-C 112.259 -0.337 . . . . 0.0 112.259 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.05 38.72 1.44 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.996 0.427 . . . . 0.0 111.097 -179.552 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -79.26 52.28 1.31 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.631 179.568 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -164.59 124.31 1.94 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.325 178.144 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 17.9 p -169.14 133.61 1.45 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.308 179.627 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -83.56 42.73 0.85 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.947 0.403 . . . . 0.0 111.311 -178.612 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 7.4 t -89.5 125.22 35.1 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.902 0.382 . . . . 0.0 110.164 179.443 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 70.8 37.57 66.18 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.967 -0.56 . . . . 0.0 113.025 179.41 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 71.8 t -100.4 112.11 63.77 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.632 0.253 . . . . 0.0 110.401 177.743 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.13 125.95 13.73 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 122.679 2.253 . . . . 0.0 111.839 -179.934 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 55.4 t -82.2 123.99 38.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.239 178.585 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 17.1 m -75.3 -45.49 39.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.047 0.451 . . . . 0.0 110.156 179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -164.4 118.9 1.42 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.718 175.67 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . 0.544 HG22 ' HG3' ' A' ' 435' ' ' GLN . 25.9 m -68.98 -62.85 1.2 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.563 -178.488 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . 0.544 ' HG3' HG22 ' A' ' 434' ' ' THR . 0.0 OUTLIER -179.28 133.79 0.12 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.155 177.867 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 13.5 p -93.61 -42.77 9.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.502 179.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 56.28 36.7 27.92 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.732 178.619 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 60.03 56.74 22.99 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.193 178.337 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . 0.456 ' HB3' ' HB ' ' A' ' 442' ' ' THR . . . 65.82 58.57 0.77 Allowed 'General case' 0 C--O 1.235 0.33 0 C-N-CA 122.62 0.368 . . . . 0.0 111.004 -177.328 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 72.64 -57.34 0.63 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.026 0.931 . . . . 0.0 112.302 -179.467 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.2 t -169.32 26.91 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.945 0.402 . . . . 0.0 110.606 179.288 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.456 ' HB ' ' HB3' ' A' ' 439' ' ' ALA . 54.7 m -74.39 -46.74 38.4 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.622 175.181 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 57.46 55.43 5.72 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -174.864 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.634 ' HB2' ' HB2' ' A' ' 447' ' ' LYS . 22.2 pt-20 -70.12 57.43 0.16 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.778 -172.287 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -64.79 -35.89 82.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.403 178.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.525 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 12.6 t -75.21 -17.17 60.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.15 -177.541 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 444' ' ' GLU . 17.9 tttp -54.59 124.69 17.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.057 0.455 . . . . 0.0 111.089 -176.029 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 83.07 26.99 42.31 Favored Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.51 -0.768 . . . . 0.0 114.647 173.277 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.894 ' HB2' ' SG ' ' A' ' 454' ' ' CYS . 42.6 mtpt -84.05 -25.78 29.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.049 0.925 . . . . 0.0 109.226 170.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 96.19 141.14 11.65 Favored Glycine 0 C--O 1.215 -1.071 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.619 -177.825 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -45.34 -43.74 11.1 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -171.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -57.89 -43.69 86.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.062 0.458 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.72 ' OD2' ' HE2' ' A' ' 449' ' ' LYS . 23.6 t0 -81.5 -45.3 16.15 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.332 179.524 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.894 ' SG ' ' HB2' ' A' ' 449' ' ' LYS . 70.9 m -71.64 64.58 0.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.892 1.277 . . . . 0.0 111.331 174.986 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -65.72 145.4 56.06 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.817 -178.102 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 20.0 m -56.2 -48.37 97.01 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -175.77 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.3 Cg_endo -62.31 -33.05 81.6 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 121.491 1.461 . . . . 0.0 111.712 177.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -79.96 -40.97 26.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.145 -178.469 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 97.9 m -146.14 142.24 28.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.512 -176.308 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -75.2 125.21 28.49 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.851 0.358 . . . . 0.0 110.791 179.367 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.705 ' HZ3' ' SG ' ' A' ' 466' ' ' CYS . 26.9 t-105 -96.44 115.93 28.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.696 178.966 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -89.07 -47.37 8.15 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.922 0.391 . . . . 0.0 110.907 -178.381 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 171.76 65.85 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 82.69 37.94 12.85 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.513 -174.137 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 15.0 t -167.56 136.7 2.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.739 0.304 . . . . 0.0 110.393 178.569 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.705 ' SG ' ' HZ3' ' A' ' 461' ' ' TRP . 0.0 OUTLIER -102.15 138.9 38.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.194 -176.405 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -172.93 -173.29 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.919 0.39 . . . . 0.0 110.614 176.796 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 31.7 t70 . . . . . 0 C--O 1.248 1.002 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.33 176.404 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 112.088 -0.405 . . . . 0.0 112.088 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 4.1 m 58.73 38.49 24.89 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.547 0.689 . . . . 0.0 110.447 -179.661 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -102.23 138.17 39.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.454 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -145.03 43.16 1.32 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.883 -178.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 8.6 t 62.15 -150.14 0.37 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.424 -178.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . 0.522 ' HD3' ' N ' ' A' ' 426' ' ' LYS . 0.0 OUTLIER -166.27 133.56 2.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -177.033 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 72.3 m 66.41 140.4 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.543 0.687 . . . . 0.0 112.04 -178.31 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -65.71 131.09 34.27 Favored Glycine 0 N--CA 1.447 -0.626 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.424 -177.561 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 7.5 p -167.82 126.85 1.02 Allowed Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.658 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -75.67 122.83 7.11 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.298 1.998 . . . . 0.0 111.738 -179.065 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 15.6 m -75.92 132.6 32.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.459 178.862 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 57.7 m 72.24 128.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.58 0.705 . . . . 0.0 111.462 -178.067 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -157.05 -53.03 0.08 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.485 178.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.29 123.58 3.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.526 174.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . 0.603 ' HG2' HG22 ' A' ' 436' ' ' THR . 1.6 pm0 -72.21 -29.93 64.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.207 0.527 . . . . 0.0 109.949 177.941 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . 0.603 HG22 ' HG2' ' A' ' 435' ' ' GLN . 10.7 t -167.79 134.4 2.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.177 178.407 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -164.77 140.2 5.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.872 0.368 . . . . 0.0 110.737 -175.244 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 162.98 -46.04 0.33 Allowed Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.242 179.269 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 58.2 50.37 9.94 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.377 0.608 . . . . 0.0 110.221 -176.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -157.19 147.94 21.47 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.523 -176.293 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.8 m 70.53 57.51 0.25 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.863 0.84 . . . . 0.0 110.488 -176.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 445' ' ' LYS . 11.4 m -82.79 59.11 4.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.43 175.971 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -69.04 -90.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.505 -170.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 447' ' ' LYS . 37.7 tt0 -77.05 24.86 0.16 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -172.385 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.511 ' HB2' HG22 ' A' ' 442' ' ' THR . 13.6 mmmm -82.97 -36.29 25.24 Favored 'General case' 0 C--N 1.311 -1.109 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 163.725 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.471 ' O ' ' HG3' ' A' ' 449' ' ' LYS . 57.6 m -106.4 -36.15 6.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.498 176.201 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 444' ' ' GLU . 19.5 tptm -64.74 128.38 35.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.113 0.482 . . . . 0.0 110.999 -175.592 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.78 22.2 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.496 -0.774 . . . . 0.0 113.25 177.436 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 446' ' ' CYS . 43.4 mtpt -99.04 -48.82 4.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.128 0.489 . . . . 0.0 110.406 174.127 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 102.75 153.61 24.6 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -175.93 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.04 -39.92 83.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.88 0.34 . . . . 0.0 111.434 -177.499 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -86.57 37.6 0.75 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.249 0.547 . . . . 0.0 111.08 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -157.06 -45.93 0.07 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.333 -0.848 . . . . 0.0 108.889 177.513 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 37.1 t -63.22 115.91 4.96 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.199 175.003 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.477 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 94.8 mttt -101.74 141.06 35.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.573 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.487 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 22.1 m -56.13 -50.47 87.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.282 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 456' ' ' SER . 32.8 Cg_endo -63.33 -31.64 73.11 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.535 1.49 . . . . 0.0 110.942 177.339 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.477 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 14.6 t70 -71.32 -52.38 19.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.715 179.56 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.493 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 70.8 m -156.65 147.52 21.86 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -178.8 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -81.1 122.87 27.88 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.817 -176.345 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -87.56 106.64 18.14 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 174.383 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -146.62 130.31 16.99 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -174.664 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 64.18 32.42 84.12 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.788 -175.016 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 64.48 24.01 69.02 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.282 -177.479 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 57.0 m -132.18 133.75 44.57 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 120.797 0.332 . . . . 0.0 110.459 -177.65 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 31.2 t -88.96 118.77 28.93 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.343 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -161.72 144.61 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -174.587 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' A' ' 459' ' ' CYS . 9.8 t70 . . . . . 0 C--O 1.245 0.844 0 O-C-N 124.311 1.007 . . . . 0.0 110.972 -179.26 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.741 0 N-CA-C 112.004 -0.438 . . . . 0.0 112.004 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 5.1 p -67.12 -48.33 68.42 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.738 0.304 . . . . 0.0 110.804 179.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -75.16 139.7 42.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.338 177.004 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -75.4 56.79 0.87 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.967 0.413 . . . . 0.0 111.726 -178.556 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.8 m -66.83 132.37 47.87 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.334 178.919 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -70.82 124.27 23.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.351 0.596 . . . . 0.0 111.045 -178.39 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 22.7 t -90.82 -143.92 0.18 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.234 179.016 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -70.88 110.65 3.35 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 172.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 21.5 m -62.9 132.27 94.85 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-O 121.027 0.442 . . . . 0.0 111.483 -173.729 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -70.86 137.44 32.26 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.831 2.354 . . . . 0.0 112.098 -178.459 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 29.7 m -66.85 148.24 12.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.239 177.54 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 14.6 t -56.9 137.17 55.6 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 -178.719 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -58.93 129.3 41.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.875 -175.491 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 17.3 m -136.63 139.25 41.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.279 -177.504 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -51.97 -57.29 9.89 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.715 -175.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 4.8 t -175.46 66.27 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.589 0.709 . . . . 0.0 110.063 -175.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 60.52 -129.33 0.93 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.413 -176.502 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -86.2 38.02 3.09 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.735 178.375 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 70.25 139.46 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 123.478 0.711 . . . . 0.0 111.796 -179.176 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -83.04 42.57 0.81 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.968 177.43 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.6 p -64.77 -41.88 95.53 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 173.756 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.403 HG21 ' HG2' ' A' ' 467' ' ' LYS . 5.2 m -70.97 133.31 46.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.765 171.044 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -58.76 140.71 54.55 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 123.176 0.297 . . . . 0.0 110.54 179.357 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.726 ' HA ' ' HB2' ' A' ' 447' ' ' LYS . 2.1 mp0 -79.33 27.92 0.25 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.72 -175.892 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -71.92 -34.2 68.89 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 168.063 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.559 ' O ' ' HE2' ' A' ' 449' ' ' LYS . 57.9 m -113.38 -49.77 2.89 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 113.933 -1.485 . . . . 0.0 109.731 172.586 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.726 ' HB2' ' HA ' ' A' ' 444' ' ' GLU . 63.5 tttp 59.08 144.97 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.887 0.875 . . . . 0.0 112.844 176.706 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.553 ' HA2' ' H ' ' A' ' 466' ' ' CYS . . . -73.14 51.86 1.7 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.857 179.311 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.559 ' HE2' ' O ' ' A' ' 446' ' ' CYS . 33.6 mtmt -74.48 -152.21 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 179.773 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -83.26 156.23 33.59 Favored Glycine 0 N--CA 1.443 -0.88 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 174.234 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -41.07 98.53 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.685 0.279 . . . . 0.0 111.301 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -69.05 -34.05 74.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.835 0.35 . . . . 0.0 110.51 179.942 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.33 -51.83 27.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.663 176.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 16.0 t -53.67 129.84 34.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.032 174.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.97 116.81 23.58 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 173.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.571 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 25.0 m -65.93 -47.04 64.92 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.413 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 456' ' ' SER . 18.1 Cg_endo -57.98 -38.44 92.05 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.667 1.578 . . . . 0.0 111.645 177.591 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -76.76 -48.22 19.34 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.175 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 60.6 m -130.4 142.54 50.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 111.189 -175.178 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -76.95 133.98 39.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.072 0.463 . . . . 0.0 110.99 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -102.98 119.84 39.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.479 176.512 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -159.94 143.68 14.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.686 0.279 . . . . 0.0 110.674 178.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 61.17 32.1 79.33 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.782 -0.644 . . . . 0.0 112.285 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 63.13 41.82 99.63 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.975 179.375 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.7 t -160.4 146.89 15.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.012 0.434 . . . . 0.0 110.496 178.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.706 ' HB3' ' O ' ' A' ' 447' ' ' LYS . 20.6 t -97.48 121.25 39.16 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.711 -176.748 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.403 ' HG2' HG21 ' A' ' 442' ' ' THR . 49.8 mtmt -133.56 141.85 47.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.792 0.33 . . . . 0.0 111.576 -175.869 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.519 -0.753 . . . . 0.0 109.718 175.036 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.847 0 N-CA-C 112.182 -0.367 . . . . 0.0 112.182 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 4.8 m -81.73 53.81 2.24 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.358 0.599 . . . . 0.0 110.519 179.111 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -73.03 -46.04 54.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.517 -178.262 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -84.31 140.24 31.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.082 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 6.9 p -126.88 -84.63 0.61 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.127 177.4 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp 55.55 61.16 2.96 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.438 0.637 . . . . 0.0 110.361 176.083 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 12.3 p -69.39 -20.48 63.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.771 -175.613 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -63.1 171.46 12.54 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.053 -0.594 . . . . 0.0 112.341 179.287 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 46.0 t -67.36 126.07 92.01 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 178.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -63.24 147.48 93.84 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.679 2.252 . . . . 0.0 112.494 -178.174 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 15.7 t -77.85 59.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.467 0.651 . . . . 0.0 110.04 178.186 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 8.8 m -70.86 -28.7 64.77 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.204 -175.615 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 47.36 -135.62 0.95 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.716 0.806 . . . . 0.0 110.833 -175.874 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 6.2 t 46.61 39.07 6.38 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.593 0.757 . . . . 0.0 111.485 179.149 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -74.54 -45.27 46.72 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.583 178.097 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 58.2 m -64.84 -51.42 62.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.64 -177.689 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -170.13 143.32 2.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.812 0.339 . . . . 0.0 111.367 -179.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -171.37 130.09 1.9 Allowed Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.811 178.654 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 58.59 42.96 19.82 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.136 0.493 . . . . 0.0 111.051 -178.106 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -76.32 159.35 30.63 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.917 179.469 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 17.9 m -54.55 122.97 11.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.494 -176.772 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 15.4 t -175.88 -24.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.868 -178.595 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 75.96 131.46 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.517 0.727 . . . . 0.0 110.666 -174.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 1.033 ' HG2' ' HB2' ' A' ' 467' ' ' LYS . 1.2 tp10 57.94 27.07 14.19 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.337 -176.248 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.703 ' HE2' ' HB2' ' A' ' 468' ' ' ASP . 16.3 ttpt 51.15 21.33 1.04 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.426 176.894 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.48 ' SG ' ' HD2' ' A' ' 449' ' ' LYS . 0.5 OUTLIER -172.32 -26.21 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -174.356 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -55.1 113.0 1.19 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.909 0.385 . . . . 0.0 110.982 -174.713 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 132.83 -30.86 3.03 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.295 -174.51 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.48 ' HD2' ' SG ' ' A' ' 446' ' ' CYS . 96.0 mttt -63.93 140.41 58.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.733 -0.233 . . . . 0.0 110.996 178.429 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.52 172.67 47.89 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 171.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.82 -41.73 78.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.277 0.539 . . . . 0.0 111.101 -178.594 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -71.57 -41.75 68.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.487 -178.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.62 -35.57 80.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.293 0.568 . . . . 0.0 110.451 177.008 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 15.9 t -68.37 109.16 3.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.522 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -85.18 126.92 34.04 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.528 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -59.4 -49.58 91.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -175.725 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.4 Cg_endo -61.0 -33.21 92.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.716 1.611 . . . . 0.0 111.67 178.659 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -78.04 -45.39 23.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.505 -179.681 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 57.6 m -146.87 143.14 28.34 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 -178.901 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 467' ' ' LYS . 16.4 ptpt -86.41 135.54 33.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.205 0.526 . . . . 0.0 110.798 178.237 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.403 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 77.2 t-105 -95.28 121.14 36.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.52 -175.859 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -81.52 -135.72 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.485 178.56 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.81 -43.1 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.317 177.1 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -155.28 44.68 0.55 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.549 -0.621 . . . . 0.0 111.549 179.542 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 14.6 t -162.29 136.19 6.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.368 0.604 . . . . 0.0 110.554 178.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 459' ' ' CYS . 35.5 t -96.29 134.9 38.84 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.47 -0.786 . . . . 0.0 108.943 178.415 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 1.033 ' HB2' ' HG2' ' A' ' 444' ' ' GLU . 0.0 OUTLIER -153.0 135.07 14.8 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.911 -0.716 . . . . 0.0 111.715 -178.113 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.703 ' HB2' ' HE2' ' A' ' 445' ' ' LYS . 23.2 t70 . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.486 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.712 0 N-CA-C 112.115 -0.394 . . . . 0.0 112.115 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 69.9 m -69.52 126.16 28.9 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.61 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm 69.48 133.31 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.91 0.756 . . . . 0.0 110.778 -174.746 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -60.42 -49.69 76.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.404 179.422 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 36.5 p 44.85 48.25 9.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.102 176.455 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -173.36 -45.51 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.474 178.605 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 15.0 m -74.55 115.5 14.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.016 -179.312 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . 0.499 ' O ' HG22 ' A' ' 429' ' ' VAL . . . 74.75 -60.26 2.53 Favored Glycine 0 CA--C 1.52 0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 113.494 177.092 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 428' ' ' GLY . 5.9 m 55.9 135.53 0.02 OUTLIER Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 125.373 1.469 . . . . 0.0 113.512 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 2.9 Cg_exo -76.21 35.2 0.45 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 123.195 2.597 . . . . 0.0 112.664 -178.974 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 52.1 t -94.58 114.8 31.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.242 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 9.9 t -167.06 138.81 3.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.35 -175.925 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -143.55 36.27 1.32 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.139 0.495 . . . . 0.0 110.327 -179.458 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 2.3 p -77.68 50.78 0.86 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.484 177.459 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -134.07 -49.61 0.81 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 176.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 9.5 p -79.94 -50.4 10.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.471 170.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -84.45 131.58 34.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.868 173.103 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -171.17 39.94 0.18 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.395 -0.907 . . . . 0.0 112.342 -178.492 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 68.78 142.66 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.609 0.719 . . . . 0.0 112.058 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 39.4 p30 -82.6 27.97 0.49 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.155 -177.297 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.2 m -94.51 -54.66 3.43 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 173.434 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . 0.992 HG22 ' HA ' ' A' ' 445' ' ' LYS . 7.3 m -100.35 52.83 0.89 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.288 174.094 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -62.24 -56.08 22.1 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.545 -174.601 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.5 25.84 5.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.363 0.602 . . . . 0.0 110.494 177.92 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.992 ' HA ' HG22 ' A' ' 442' ' ' THR . 29.3 mtpp 53.1 31.74 11.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.466 -1.243 . . . . 0.0 112.363 177.674 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 2.4 t 66.31 7.49 4.95 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.488 0.715 . . . . 0.0 110.86 175.643 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 62.0 tttp -75.76 128.17 34.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.176 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 133.22 -37.93 1.93 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.281 179.3 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.271 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.33 179.42 25.08 Favored Glycine 0 C--O 1.226 -0.359 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.7 175.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.98 -43.75 94.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.219 0.51 . . . . 0.0 111.558 -176.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.93 -40.47 91.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.044 0.45 . . . . 0.0 110.354 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -69.95 -41.01 75.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.912 -179.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.5 114.12 2.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.098 -177.355 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 458' ' ' ASP . 49.8 mtmt -72.6 117.23 14.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 176.048 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.507 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 19.7 t -64.59 -50.35 65.68 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -173.883 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 456' ' ' SER . 29.6 Cg_endo -61.47 -29.81 85.68 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.632 1.555 . . . . 0.0 111.649 178.514 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.562 ' HB2' ' HB2' ' A' ' 455' ' ' LYS . 1.0 OUTLIER -85.35 -40.91 15.97 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.221 -176.032 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.5 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 9.2 m -137.88 144.66 41.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.678 0.275 . . . . 0.0 110.452 -174.629 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 460' ' ' LYS . 4.4 mptp? -80.9 148.02 30.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.089 0.471 . . . . 0.0 110.532 178.67 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -107.43 123.02 47.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.454 178.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.515 ' HG2' ' H ' ' A' ' 463' ' ' GLY . 22.9 tt0 -85.33 -136.67 0.06 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 177.268 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . 0.515 ' H ' ' HG2' ' A' ' 462' ' ' GLU . . . -73.88 -42.76 36.93 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 110.904 -0.879 . . . . 0.0 110.904 175.132 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -158.99 42.59 0.48 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 177.456 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 91.2 m -148.47 129.19 14.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.811 0.339 . . . . 0.0 110.943 -176.96 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.547 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 8.7 t -83.6 135.79 34.48 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.139 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.727 ' HA ' ' O ' ' A' ' 445' ' ' LYS . 60.5 pttt -159.78 134.89 8.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.467 0.651 . . . . 0.0 111.887 -179.659 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.684 178.12 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.613 0 N-CA-C 111.731 -0.548 . . . . 0.0 111.731 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 17.0 m 56.41 44.69 24.02 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.67 0.748 . . . . 0.0 110.964 178.812 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -166.14 35.66 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.194 177.682 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -165.29 129.54 2.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.179 178.619 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 43.6 m -151.71 -37.78 0.12 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.995 0.426 . . . . 0.0 110.328 -177.886 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -150.93 -136.57 0.07 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.833 178.966 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 10.0 t 62.33 44.87 7.08 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.425 0.631 . . . . 0.0 109.958 179.999 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 177.15 136.13 2.36 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.501 -178.779 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.482 HG22 HG22 ' A' ' 431' ' ' VAL . 11.5 p -136.51 130.22 17.91 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-O 120.751 0.31 . . . . 0.0 110.237 -178.6 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 52.1 Cg_exo -57.3 -35.39 98.88 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.964 2.443 . . . . 0.0 112.742 -175.933 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.796 ' HA ' ' HG2' ' A' ' 435' ' ' GLN . 27.5 m -84.43 38.16 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-O 121.129 0.49 . . . . 0.0 111.377 179.193 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 14.6 t -69.47 143.42 53.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.668 178.72 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 94.2 mm-40 63.6 40.58 7.91 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.998 -176.238 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 1.4 m 58.32 26.31 13.83 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.394 -178.16 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . 0.796 ' HG2' ' HA ' ' A' ' 431' ' ' VAL . 0.5 OUTLIER 64.73 124.6 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.391 -176.614 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 8.8 t -161.23 38.21 0.14 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.579 0.704 . . . . 0.0 109.847 178.777 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -158.81 33.89 0.22 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.231 177.525 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -73.02 -42.88 42.76 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.044 179.743 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -155.45 138.08 15.13 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 177.975 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -61.44 132.27 52.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.419 -178.459 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 17.1 p 50.53 39.54 21.32 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.344 0.658 . . . . 0.0 112.03 -179.147 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 90.9 m 70.28 -52.7 0.65 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.422 0.689 . . . . 0.0 112.266 178.742 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . 55.25 -141.21 0.87 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -176.514 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -103.73 33.16 3.51 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.777 175.57 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 44.0 tttp -71.25 -36.5 71.79 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.717 171.633 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.578 ' O ' ' HB3' ' A' ' 466' ' ' CYS . 63.8 m -123.24 -32.89 3.37 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.592 178.37 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -71.85 125.67 27.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 110.595 -177.004 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 130.08 -29.57 3.68 Favored Glycine 0 N--CA 1.441 -0.971 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.315 -178.803 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.544 ' HB2' ' CB ' ' A' ' 453' ' ' ASP . 9.8 pttm -97.45 139.11 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.638 178.942 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -73.22 -168.88 14.54 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.418 -174.76 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.32 -40.87 90.2 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 122.658 0.383 . . . . 0.0 111.484 -176.785 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -62.5 -41.52 98.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.154 0.502 . . . . 0.0 110.119 178.071 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.544 ' CB ' ' HB2' ' A' ' 449' ' ' LYS . 90.6 m-20 -73.73 -41.61 62.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.528 -179.411 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 7.8 t -63.41 118.76 8.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.84 -176.038 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -156.65 172.97 17.64 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.545 -178.779 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.434 ' OG ' ' HD2' ' A' ' 457' ' ' PRO . 5.9 t 68.58 147.61 0.11 Allowed Pre-proline 0 C--O 1.226 -0.159 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.178 175.11 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.434 ' HD2' ' OG ' ' A' ' 456' ' ' SER . 27.3 Cg_endo -61.64 -1.56 2.11 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.507 2.138 . . . . 0.0 111.748 177.684 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.35 -37.28 68.88 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.1 174.949 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.49 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 79.8 m -135.64 131.86 36.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.367 177.081 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -105.96 133.39 50.75 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.979 -177.818 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -85.82 132.68 34.06 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 174.689 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -157.31 128.98 6.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.056 -0.257 . . . . 0.0 111.01 -178.132 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 68.54 -70.59 0.37 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.015 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . -175.57 31.69 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 177.471 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.1 m -151.23 134.85 16.32 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -177.014 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 446' ' ' CYS . 17.0 t -84.97 125.82 33.01 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.049 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.491 ' HA ' ' HB2' ' A' ' 446' ' ' CYS . 22.5 pttp -156.79 144.01 18.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.671 0.272 . . . . 0.0 111.065 -176.247 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.887 -176.987 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.945 0 N-CA-C 111.762 -0.535 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 21.9 p -82.34 -140.55 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.654 0.264 . . . . 0.0 111.2 178.917 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -157.63 -54.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.871 0.367 . . . . 0.0 110.235 179.417 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -88.62 -43.9 11.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.861 176.724 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 13.2 m 67.71 128.76 0.02 OUTLIER 'General case' 0 C--O 1.235 0.317 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.275 179.892 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 3.2 pptp? -73.56 -26.07 60.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.307 178.985 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 23.5 m 59.73 86.66 0.09 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.654 175.148 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -178.44 127.46 1.16 Allowed Glycine 0 N--CA 1.442 -0.917 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.618 178.121 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.433 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 15.6 m -62.34 137.66 96.1 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-O 120.817 0.341 . . . . 0.0 110.848 -178.9 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.569 ' HB2' HG23 ' A' ' 432' ' ' THR . 24.3 Cg_exo -65.59 142.9 72.99 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.676 2.25 . . . . 0.0 112.064 -177.609 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 20.3 t -77.75 67.01 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.327 0.584 . . . . 0.0 109.633 177.228 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . 0.569 HG23 ' HB2' ' A' ' 430' ' ' PRO . 5.5 p -73.55 59.64 0.63 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.013 -174.707 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -144.03 -45.67 0.26 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.86 177.402 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 8.6 t -87.16 132.43 33.86 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 171.764 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -171.13 124.65 0.63 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.591 -176.184 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 14.2 t 40.35 47.83 2.26 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.422 1.089 . . . . 0.0 112.487 179.075 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 70.96 -48.4 0.67 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.916 0.886 . . . . 0.0 112.611 177.504 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 69.99 -140.61 33.09 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.978 -179.451 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . 52.45 54.5 10.56 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.842 0.353 . . . . 0.0 111.699 177.783 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -71.15 -50.35 34.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.975 0.417 . . . . 0.0 111.254 -176.963 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 6.9 m -77.26 -54.4 6.53 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.187 -176.754 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 15.2 t -85.19 130.05 34.68 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.896 0.379 . . . . 0.0 110.508 178.432 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -82.93 39.45 0.63 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.919 0.39 . . . . 0.0 110.639 179.106 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.94 ' HG3' ' HB3' ' A' ' 447' ' ' LYS . 30.9 tt0 54.81 43.5 29.94 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.703 0.763 . . . . 0.0 110.605 -178.438 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -64.21 -38.93 92.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.411 176.55 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.789 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 73.2 m -122.56 -11.03 8.32 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 113.98 -1.464 . . . . 0.0 112.642 -166.315 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.94 ' HB3' ' HG3' ' A' ' 444' ' ' GLU . 85.2 tttt -67.42 105.67 1.87 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.104 179.872 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 137.52 -28.19 2.79 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.213 -179.643 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -86.6 154.34 21.12 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.416 -176.902 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.57 177.44 30.06 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.83 -176.253 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.01 -50.74 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.844 -0.209 . . . . 0.0 110.973 -177.9 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -68.18 -31.07 70.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.936 0.398 . . . . 0.0 110.535 179.55 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.55 -34.73 72.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.02 178.571 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 48.9 t -60.12 116.76 4.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.23 179.842 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.492 ' HB2' ' HB3' ' A' ' 458' ' ' ASP . 35.9 mtmm -81.04 124.78 29.46 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.709 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.425 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 9.6 m -62.93 -54.08 49.92 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -172.418 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 456' ' ' SER . 22.5 Cg_endo -62.08 -28.37 80.05 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.475 1.45 . . . . 0.0 111.235 178.976 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.492 ' HB3' ' HB2' ' A' ' 455' ' ' LYS . 45.3 t0 -75.03 -50.96 14.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.972 178.089 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.498 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 98.2 m -148.54 148.39 30.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.404 0.621 . . . . 0.0 111.509 -175.169 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -92.35 139.58 30.45 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.282 177.241 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 48.9 t-105 -77.2 119.78 21.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 176.158 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -149.3 130.42 14.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.84 0.352 . . . . 0.0 110.454 -176.587 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.75 38.27 91.66 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.377 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 60.58 33.95 84.01 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.258 -0.496 . . . . 0.0 112.313 -177.815 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 85.9 m -150.82 135.84 17.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.695 0.283 . . . . 0.0 110.287 -177.002 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.789 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 20.0 t -78.63 124.94 28.7 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -161.39 134.28 6.21 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.137 0.494 . . . . 0.0 111.39 -174.907 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . 0.433 ' HB3' ' HA ' ' A' ' 459' ' ' CYS . 29.4 p-10 . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.642 177.91 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.714 0 N-CA-C 112.191 -0.364 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . . . . . . . . . 6.6 m -67.99 129.73 40.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.595 0.236 . . . . 0.0 110.388 -179.704 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.07 35.3 0.14 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.927 -177.198 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . 69.6 145.93 0.06 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.403 -179.356 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.7 m -57.08 139.15 53.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.893 -178.152 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -54.08 124.68 16.34 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.203 -177.466 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 51.0 m -160.36 129.33 4.9 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.16 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -152.21 36.34 0.82 Allowed Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.084 -177.521 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 7.3 p -177.12 126.9 0.3 Allowed Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 177.067 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 18.4 Cg_exo -68.52 -34.87 18.89 Favored 'Trans proline' 0 C--O 1.234 0.301 0 C-N-CA 122.772 2.314 . . . . 0.0 111.535 -177.625 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 14.2 t 64.48 47.9 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.634 -176.876 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 23.5 m -69.29 -39.42 78.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.492 177.264 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 7.2 tm0? -134.58 118.59 17.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.056 -0.975 . . . . 0.0 108.433 174.174 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 12.3 m -63.95 116.85 6.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.606 -176.093 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -54.74 -49.63 70.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.858 -177.434 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 7.9 m 72.56 -38.72 0.43 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 122.864 0.466 . . . . 0.0 112.059 177.097 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 61.16 -139.01 0.54 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.982 0.513 . . . . 0.0 111.285 178.635 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 84.18 140.23 4.48 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.988 -177.686 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -156.52 134.13 10.87 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 -179.757 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 60.68 40.55 16.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.837 -176.594 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 2.7 m -75.24 -43.14 53.26 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.422 0.63 . . . . 0.0 109.552 176.79 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 12.9 m -158.27 125.34 4.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.337 179.47 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -64.86 -37.81 88.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.032 0.444 . . . . 0.0 110.451 -179.572 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.432 ' HG2' ' HB3' ' A' ' 447' ' ' LYS . 86.1 mt-10 63.36 42.64 6.68 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.002 -0.999 . . . . 0.0 112.448 175.726 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -79.37 -34.75 41.71 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 170.065 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.881 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 81.9 m -97.82 -44.42 6.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.425 174.174 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 466' ' ' CYS . 1.1 tmtp? -52.76 127.41 23.18 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.543 -178.795 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 108.89 -28.57 11.03 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.606 -178.868 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.881 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 57.0 mtmt -72.28 144.68 48.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.793 0.296 . . . . 0.0 111.132 -178.888 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -69.84 175.25 34.92 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 175.935 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.52 -37.09 74.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 117.346 0.573 . . . . 0.0 111.459 -177.253 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -68.6 -41.67 79.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.234 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.613 ' HB3' ' HD2' ' A' ' 449' ' ' LYS . 1.1 m-20 -75.96 -36.87 59.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 110.56 178.852 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.48 ' SG ' ' N ' ' A' ' 455' ' ' LYS . 36.9 t -77.55 -157.73 0.1 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.351 179.589 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 454' ' ' CYS . 27.7 mmmt 61.36 49.67 5.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.862 0.839 . . . . 0.0 110.749 -175.282 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.46 ' C ' ' H ' ' A' ' 458' ' ' ASP . 0.9 OUTLIER -71.77 171.72 8.59 Favored Pre-proline 0 C--N 1.31 -1.127 0 CA-C-N 114.438 -1.255 . . . . 0.0 108.974 176.06 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 456' ' ' SER . 71.8 Cg_endo -77.57 29.07 0.43 Allowed 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.102 1.868 . . . . 0.0 111.097 175.949 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' A' ' 456' ' ' SER . 49.6 t0 -158.52 -49.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.489 -179.121 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 69.3 m -79.34 137.54 37.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.991 -179.484 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -115.22 160.48 19.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.306 0.574 . . . . 0.0 111.594 -178.563 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.449 ' HZ3' ' HB2' ' A' ' 466' ' ' CYS . 37.1 t-105 -91.46 136.27 33.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.79 179.202 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.54 ' O ' HG22 ' A' ' 465' ' ' THR . 36.8 tt0 -128.24 75.38 1.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.944 0.402 . . . . 0.0 111.691 -177.59 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 60.78 57.96 16.19 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.756 175.383 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 78.99 40.79 15.69 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.947 178.762 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.54 HG22 ' O ' ' A' ' 462' ' ' GLU . 6.3 t -166.87 143.12 4.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 175.334 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.621 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 36.6 t -98.91 139.73 34.13 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.576 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 462' ' ' GLU . 21.9 pttp -153.54 152.13 30.58 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.993 0.425 . . . . 0.0 111.103 -178.363 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.337 175.251 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.751 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . 0.41 HG21 ' HA ' ' A' ' 430' ' ' PRO . 52.7 p 54.06 115.02 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.245 1.018 . . . . 0.0 112.731 178.317 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . 0.404 ' HD2' ' N ' ' A' ' 423' ' ' LYS . 4.1 mptp? -67.63 137.36 55.55 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.118 177.725 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -61.28 126.93 29.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.117 -176.606 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 10.9 t 56.72 50.48 12.53 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.692 -179.362 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -153.14 139.26 18.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.369 -179.244 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 13.0 m -65.49 137.66 57.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.605 -176.792 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -174.33 -148.1 6.4 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.828 178.845 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 25.4 t -123.9 104.07 33.3 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-O 120.805 0.336 . . . . 0.0 110.575 179.488 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.41 ' HA ' HG21 ' A' ' 422' ' ' THR . 15.5 Cg_exo -69.29 -43.67 2.9 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.927 2.418 . . . . 0.0 112.023 -179.036 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 22.1 m -71.16 143.63 14.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.411 -179.856 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 42.3 m -72.9 -40.12 65.81 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.665 179.062 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -67.34 135.03 52.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.906 178.44 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 14.6 m -79.67 74.79 6.35 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.461 178.549 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 95.0 mm-40 62.21 -130.22 0.62 Allowed 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.765 -176.809 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 13.2 p -81.84 -17.87 45.93 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.417 179.515 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . 63.45 -143.29 0.34 Allowed 'General case' 0 C--O 1.231 0.103 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.752 -177.478 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . -70.34 134.5 24.75 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.288 179.633 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -161.77 128.5 3.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.632 0.253 . . . . 0.0 110.944 -179.812 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -72.18 -41.67 66.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.809 0.814 . . . . 0.0 109.827 177.804 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 54.1 m -165.51 -41.55 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.338 -1.301 . . . . 0.0 107.686 -179.963 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.3 126.33 35.82 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.847 172.215 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -61.38 -41.39 97.03 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.32 0.581 . . . . 0.0 110.433 -179.61 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 447' ' ' LYS . 8.0 pt-20 -59.98 108.37 0.76 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.687 179.629 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 17.1 mtmm -75.91 49.0 0.51 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.455 177.572 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.753 ' HB3' ' SG ' ' A' ' 466' ' ' CYS . 59.0 m -141.85 -23.78 0.7 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.069 -177.385 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.454 ' HB2' ' HG3' ' A' ' 444' ' ' GLU . 22.7 tptp -56.01 107.71 0.38 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.31 -173.65 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 78.32 56.07 3.8 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.673 -0.694 . . . . 0.0 113.875 177.297 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.622 ' HG2' ' O ' ' A' ' 446' ' ' CYS . 14.5 ptpt -129.57 166.79 19.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.219 0.51 . . . . 0.0 110.692 173.451 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -72.7 165.11 54.68 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.086 -177.781 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.45 -35.11 78.57 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.318 0.247 . . . . 0.0 111.104 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 39.25 0.71 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.643 0.735 . . . . 0.0 110.388 176.694 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -156.28 -44.51 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.576 -178.566 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.48 129.46 39.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.039 176.507 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -106.73 117.76 34.91 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.325 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.51 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 26.1 t -56.95 -48.43 97.43 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -173.601 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 456' ' ' SER . 14.2 Cg_endo -58.01 -30.13 89.05 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.625 1.55 . . . . 0.0 112.187 -179.227 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -87.95 -45.08 10.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.156 -179.842 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.497 ' O ' ' HA ' ' A' ' 456' ' ' SER . 68.4 m -143.13 142.08 31.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.947 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -89.05 147.23 24.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.731 0.777 . . . . 0.0 112.008 -175.265 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -94.82 119.52 33.54 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.345 179.615 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -146.07 129.89 17.2 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.572 0.225 . . . . 0.0 110.756 -179.161 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 58.67 42.68 96.37 Favored Glycine 0 N--CA 1.454 -0.152 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.221 -178.929 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 57.18 34.71 67.52 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.061 -177.025 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 32.7 m -143.93 130.72 20.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.715 0.293 . . . . 0.0 110.874 -175.038 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 446' ' ' CYS . 14.1 t -88.64 134.61 33.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.98 178.654 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -172.53 154.34 3.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 111.229 -179.448 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 7.6 t70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.306 -0.854 . . . . 0.0 109.478 175.057 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 421' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.534 -0.627 . . . . 0.0 111.534 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 422' ' ' THR . . . . . 0.434 ' HB ' ' H ' ' A' ' 423' ' ' LYS . 6.7 p -86.45 -142.94 0.1 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.771 0.286 . . . . 0.0 111.227 -179.628 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 423' ' ' LYS . . . . . 0.434 ' H ' ' HB ' ' A' ' 422' ' ' THR . 68.3 mttm 70.3 138.93 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.337 0.655 . . . . 0.0 111.29 -178.526 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -73.19 -20.14 60.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.886 -179.834 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 5.4 p -76.09 37.97 0.16 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -177.296 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 426' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -93.74 129.46 40.07 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 174.954 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 8.4 t -89.81 117.2 28.48 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.136 -179.952 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -77.17 -47.09 9.48 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.163 176.662 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . 0.455 ' HA ' ' HD3' ' A' ' 430' ' ' PRO . 62.1 t -75.88 132.32 74.65 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.347 -0.426 . . . . 0.0 110.178 175.528 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 430' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 429' ' ' VAL . 8.1 Cg_exo -71.55 62.67 2.91 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 123.217 2.612 . . . . 0.0 111.913 178.896 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . 0.519 ' HA ' HG21 ' A' ' 436' ' ' THR . 15.4 m -72.74 48.69 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-O 121.185 0.516 . . . . 0.0 112.125 -176.823 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 8.9 t -77.25 135.93 38.49 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.124 176.494 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 70.95 144.25 0.06 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.268 -177.257 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 2.8 p -76.42 51.8 0.74 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.583 179.856 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -164.15 33.04 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.286 0.565 . . . . 0.0 110.345 -176.793 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . 0.519 HG21 ' HA ' ' A' ' 431' ' ' VAL . 1.6 m -81.38 126.64 31.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.452 178.402 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -166.38 -39.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.638 0.256 . . . . 0.0 111.23 -179.675 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 68.41 44.69 72.58 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 -175.865 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 439' ' ' ALA . . . . . . . . . . . . . . . -150.29 -45.67 0.13 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.823 0.344 . . . . 0.0 110.942 -176.614 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 440' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -75.0 118.99 18.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.757 179.771 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -32.93 74.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.85 177.777 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 3.6 t -147.36 131.0 16.86 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.481 177.209 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -82.75 47.16 1.16 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.138 -178.59 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.838 ' HG3' ' HB3' ' A' ' 447' ' ' LYS . 31.8 tt0 55.88 46.39 22.21 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 121.636 0.732 . . . . 0.0 111.043 179.332 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -34.02 53.51 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.455 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.796 ' HA ' ' HE2' ' A' ' 449' ' ' LYS . 70.8 m -110.72 -28.19 8.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.05 179.595 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.838 ' HB3' ' HG3' ' A' ' 444' ' ' GLU . 9.1 tmtm? -61.58 130.87 48.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -173.323 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 74.5 17.01 79.81 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.52 -0.763 . . . . 0.0 114.4 175.187 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 449' ' ' LYS . . . . . 0.796 ' HE2' ' HA ' ' A' ' 446' ' ' CYS . 50.8 mtmt -93.19 137.94 32.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 117.972 0.886 . . . . 0.0 110.327 173.868 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -70.47 166.18 51.29 Favored Glycine 0 C--O 1.223 -0.538 0 C-N-CA 121.018 -0.611 . . . . 0.0 111.854 178.622 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . 0.424 ' HB2' ' CZ2' ' A' ' 461' ' ' TRP . 37.1 tt0 -59.26 -34.71 72.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.033 0.444 . . . . 0.0 111.635 -177.218 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -69.67 -44.38 70.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.803 0.335 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.54 -44.35 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.603 -179.015 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 454' ' ' CYS . . . . . 0.553 ' SG ' ' HE3' ' A' ' 449' ' ' LYS . 0.3 OUTLIER -80.29 115.9 20.08 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.305 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -87.95 148.05 24.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 178.773 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 456' ' ' SER . . . . . 0.493 ' N ' ' HD2' ' A' ' 457' ' ' PRO . 23.2 t -62.96 -51.75 68.69 Favored Pre-proline 0 C--N 1.322 -0.606 0 O-C-N 123.347 0.404 . . . . 0.0 111.605 -179.845 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 457' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 456' ' ' SER . 30.1 Cg_endo -61.81 -30.98 85.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.599 1.533 . . . . 0.0 111.46 176.584 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 458' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -71.71 -47.99 50.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.008 178.357 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 466' ' ' CYS . 63.4 m -148.55 143.12 26.42 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.157 -173.584 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 460' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.02 124.28 23.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.956 0.408 . . . . 0.0 110.781 -178.303 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 461' ' ' TRP . . . . . 0.583 ' CZ3' ' HB2' ' A' ' 466' ' ' CYS . 60.3 t-105 -107.08 126.56 52.51 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.685 178.339 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 462' ' ' GLU . . . . . 0.884 ' HB2' ' HE2' ' A' ' 467' ' ' LYS . 21.3 tt0 -90.61 -60.5 1.9 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.975 0.417 . . . . 0.0 110.133 -179.176 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 176.55 40.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 178.286 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 464' ' ' GLY . . . . . . . . . . . . . . . 147.55 -41.78 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -176.215 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . . . . . . . . . 56.6 m -104.84 134.17 48.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.469 -0.365 . . . . 0.0 111.311 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 466' ' ' CYS . . . . . 0.583 ' HB2' ' CZ3' ' A' ' 461' ' ' TRP . 1.8 t -101.09 145.1 29.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.971 178.666 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 467' ' ' LYS . . . . . 0.884 ' HE2' ' HB2' ' A' ' 462' ' ' GLU . 0.5 OUTLIER -148.16 140.17 24.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.123 0.487 . . . . 0.0 111.53 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 5.9 t70 . . . . . 0 C--O 1.251 1.158 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.507 179.676 . . . . . . . . 0 0 . 1 stop_ save_