data_2rvj_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 2rvj _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 443' ' ' VAL . . . . . . . . . . . . . 30.3 t . . . . . 0 N--CA 1.439 -1.007 0 N-CA-C 107.401 -1.333 . . . . 55.33 107.401 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.525 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 59.0 mtp85 -90.06 62.25 5.49 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 121.851 0.834 . . . . 74.51 109.813 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.2 p30 -111.43 11.73 21.46 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-N 115.005 -0.998 . . . . 71.41 110.168 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 28.3 m -109.07 151.28 26.6 Favored 'General case' 0 N--CA 1.408 -2.539 0 N-CA-C 107.797 -1.186 . . . . 64.32 107.797 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . 0.428 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.2 mt -132.13 143.9 38.7 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.39 0 N-CA-C 108.354 -0.98 . . . . 64.01 108.354 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -112.29 119.1 37.16 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 108.056 -1.09 . . . . 64.13 108.056 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 10.6 mt -94.42 141.5 28.51 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.505 -2.035 . . . . 71.13 105.505 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . 0.45 ' HE ' ' CG ' ' A' ' 490' ' ' ASP . 0.0 OUTLIER -142.65 135.83 28.48 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 119.53 -0.868 . . . . 75.02 109.861 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . 0.429 ' N ' ' HD3' ' A' ' 450' ' ' ARG . . . 99.51 22.26 13.03 Favored Glycine 0 C--N 1.28 -2.576 0 CA-C-N 114.474 -1.239 . . . . 74.12 112.188 177.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.75 144.59 96.35 Favored Pre-proline 0 C--O 1.242 0.66 0 C-N-CA 122.883 0.473 . . . . 70.41 111.974 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -57.21 160.65 12.73 Favored 'Trans proline' 0 C--O 1.252 1.218 0 C-N-CA 123.395 2.73 . . . . 64.01 113.762 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -77.19 98.61 5.15 Favored 'General case' 0 N--CA 1.401 -2.903 0 CA-C-N 113.952 -1.476 . . . . 73.14 108.686 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.96 30.43 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.485 0 CA-C-N 111.966 -2.379 . . . . 65.51 111.971 172.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -54.2 121.87 9.09 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 108.425 -0.954 . . . . 62.34 108.425 171.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 7.2 p -81.02 169.35 17.61 Favored 'General case' 0 N--CA 1.414 -2.27 0 CA-C-N 115.963 -0.562 . . . . 70.02 111.952 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.647 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 16.2 tt -67.1 -31.69 54.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 CA-C-N 116.185 -0.461 . . . . 74.33 111.957 -174.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -80.25 -28.19 38.52 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.74 -0.784 . . . . 73.42 110.264 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.62 -40.1 80.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.14 -0.936 . . . . 70.11 108.968 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.464 HG23 ' O ' ' A' ' 458' ' ' ILE . 13.5 tt -71.01 -32.88 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 115.41 -0.814 . . . . 75.22 110.065 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 93.1 mt -68.25 -40.08 82.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.327 -0.249 . . . . 75.55 110.327 178.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.97 -52.43 64.2 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 121.502 0.667 . . . . 71.12 109.28 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -53.97 -39.4 65.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.905 -1.498 . . . . 75.13 111.878 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 94.7 mt -72.64 -36.49 68.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.915 -0.584 . . . . 74.04 111.92 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.82 -140.41 25.86 Favored Glycine 0 N--CA 1.43 -1.72 0 C-N-CA 119.85 -1.167 . . . . 52.34 111.855 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.46 -17.85 63.15 Favored 'General case' 0 C--N 1.287 -2.133 0 CA-C-N 114.603 -0.798 . . . . 75.04 113.017 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . 0.41 ' O ' ' HE1' ' A' ' 495' ' ' MET . 95.2 m-85 -70.6 -22.02 62.59 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.352 0.596 . . . . 75.45 110.899 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.4 -14.65 62.65 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.453 0.644 . . . . 73.43 110.521 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 15.9 m -81.68 -18.21 45.31 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 116.201 -0.454 . . . . 74.32 111.222 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -112.97 16.13 19.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.998 0.904 . . . . 74.42 110.672 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -66.81 145.58 13.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.879 0 CA-C-N 115.761 -0.654 . . . . 73.1 109.438 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -78.5 155.29 29.88 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.3 -1.37 . . . . 64.14 107.3 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 12.3 p -54.75 114.22 1.62 Allowed 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 123.426 0.69 . . . . 51.14 111.382 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 63.11 26.19 15.24 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.69 0.796 . . . . 51.24 111.968 -176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.18 70.88 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 116.291 -0.413 . . . . 71.11 113.596 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.2 p -85.7 114.26 25.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.894 0.854 . . . . 73.12 112.245 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -124.78 113.76 18.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.079 -0.964 . . . . 73.15 109.508 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 66.1 mtt -88.94 136.97 32.73 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.924 -0.769 . . . . 74.14 108.924 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.61 121.12 37.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 N-CA-C 108.93 -0.767 . . . . 73.33 108.93 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 85.6 mt -92.95 158.7 15.68 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.756 -0.831 . . . . 75.43 108.756 179.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -106.6 -174.64 2.58 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.78 -1.563 . . . . 74.12 106.78 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -53.8 -39.96 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.771 0.828 . . . . 72.04 111.858 -176.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -68.68 -12.7 61.71 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.563 0.745 . . . . 63.44 111.993 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 84.48 24.21 47.76 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.454 -0.658 . . . . 75.22 111.454 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -127.86 152.86 77.85 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 106.937 -1.505 . . . . 72.43 106.937 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -50.55 135.12 40.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.308 2.672 . . . . 62.13 114.914 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 43.2 t -76.16 -18.75 58.97 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.662 -1.154 . . . . 73.13 109.11 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 102.09 -2.07 51.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 109.091 -1.603 . . . . 74.14 109.091 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . 0.45 ' CG ' ' HE ' ' A' ' 450' ' ' ARG . 8.6 m-20 -104.95 143.65 32.87 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 107.545 -1.279 . . . . 72.34 107.545 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -151.67 148.53 28.05 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 108.737 -0.838 . . . . 61.12 108.737 175.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . 0.401 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 70.1 m-85 -122.43 127.82 50.12 Favored 'General case' 0 C--N 1.282 -2.367 0 N-CA-C 108.692 -0.855 . . . . 73.35 108.692 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.6 mt -124.7 128.23 73.26 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 N-CA-C 109.053 -0.721 . . . . 72.24 109.053 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -102.55 123.82 46.98 Favored 'General case' 0 C--N 1.282 -2.363 0 N-CA-C 109.485 -0.561 . . . . 74.32 109.485 177.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' MET . . . . . 0.428 ' SD ' HD11 ' A' ' 447' ' ' ILE . 80.4 mtp -96.97 171.63 8.37 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.537 -0.756 . . . . 73.42 109.092 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -74.69 -38.29 62.43 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 121.284 0.564 . . . . 53.1 110.074 -177.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.7 m -115.63 141.12 48.49 Favored 'General case' 0 N--CA 1.403 -2.776 0 CA-C-N 115.432 -0.803 . . . . 71.54 110.039 -172.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -75.75 -25.04 56.16 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.334 0.587 . . . . 74.24 110.795 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.6 -40.9 55.74 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.603 -0.726 . . . . 74.3 109.45 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -63.16 -41.48 99.25 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.839 -1.073 . . . . 70.31 110.647 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -59.82 -44.03 94.25 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.503 0.502 . . . . 73.41 110.685 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 75.43 110.468 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 4.2 tpt -62.62 -41.62 99.12 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.005 -0.543 . . . . 75.52 109.845 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.37 -39.9 89.4 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.305 -0.407 . . . . 72.22 110.927 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -72.57 -22.87 60.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.345 -0.389 . . . . 64.5 111.912 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -82.57 -44.6 15.66 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 109.024 -0.732 . . . . 71.32 109.024 176.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.88 -43.24 96.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.722 -1.126 . . . . 73.12 110.045 -178.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 62.8 m -101.6 13.68 34.22 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 115.208 -0.905 . . . . 54.12 112.985 -175.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 25.3 t-80 -68.47 92.19 0.43 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.911 -0.774 . . . . 63.41 108.911 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 81.1 tttt 67.46 70.46 0.36 Allowed 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.871 1.668 . . . . 75.11 109.637 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . 0.411 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 87.1 tttt -105.21 148.08 27.32 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 113.274 -1.785 . . . . 51.2 108.363 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -84.3 117.61 23.67 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.85 -0.74 . . . . 73.44 109.623 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.442 ' SD ' HG21 ' A' ' 518' ' ' VAL . 26.3 ttt -108.37 95.37 5.62 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 106.935 -1.506 . . . . 72.1 106.935 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt 69.57 -79.39 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.335 1.022 . . . . 73.52 111.123 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -135.23 -3.65 2.43 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.944 0.878 . . . . 73.02 110.65 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -109.83 162.1 14.81 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.693 -0.855 . . . . 75.14 108.693 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -112.62 117.7 33.01 Favored 'General case' 0 N--CA 1.426 -1.653 0 N-CA-C 108.277 -1.009 . . . . 65.42 108.277 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . 0.442 HG21 ' SD ' ' A' ' 513' ' ' MET . 95.2 t -106.46 122.12 59.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.887 0 CA-C-N 114.901 -1.045 . . . . 73.23 108.563 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -99.2 114.35 27.1 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 108.434 -0.95 . . . . 71.21 108.434 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 92.6 t -104.87 136.09 40.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 CA-C-N 114.998 -1.001 . . . . 62.01 109.777 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -135.29 141.86 45.76 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.514 -0.921 . . . . 72.01 108.514 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -76.66 154.69 34.03 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 109.452 -0.573 . . . . 72.33 109.452 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.8 m -152.36 169.28 22.92 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.291 0.567 . . . . 75.32 109.535 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.525 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 76.4 p -104.35 164.92 11.4 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 108.178 -1.045 . . . . 72.14 108.178 176.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -54.71 -39.06 67.8 Favored 'General case' 0 C--N 1.307 -1.265 0 O-C-N 123.734 0.646 . . . . 73.44 110.363 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -62.93 -47.19 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.949 -0.569 . . . . 71.12 110.567 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -63.21 -37.16 86.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.374 -0.376 . . . . 73.34 111.446 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' MET . . . . . 0.411 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.3 ttt -62.79 -48.37 79.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.923 -0.58 . . . . 51.41 110.314 177.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -68.36 -34.68 76.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.3 0.571 . . . . 73.14 109.994 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.29 -41.51 96.84 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.26 -0.882 . . . . 74.13 110.906 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 62.7 t -75.98 -35.0 28.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 C-N-CA 119.709 -0.796 . . . . 63.01 110.293 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 528' ' ' MET . 91.4 mt . . . . . 0 C--O 1.241 0.653 0 CA-C-N 116.318 -0.401 . . . . 70.52 111.483 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.246 0.893 0 N-CA-C 107.692 -1.225 . . . . 75.13 107.692 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.539 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 63.7 mtm180 -85.12 66.96 10.01 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.822 0.82 . . . . 71.32 110.735 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -106.41 7.64 31.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.031 -0.986 . . . . 71.13 111.179 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.476 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 18.4 m -106.24 137.08 44.83 Favored 'General case' 0 N--CA 1.416 -2.142 0 C-N-CA 119.445 -0.902 . . . . 74.34 108.874 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -115.54 132.57 64.53 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.265 0 N-CA-C 107.557 -1.275 . . . . 55.22 107.557 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.29 125.56 50.65 Favored 'General case' 0 C--N 1.274 -2.716 0 N-CA-C 108.213 -1.032 . . . . 74.54 108.213 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 17.7 mt -105.33 143.65 33.21 Favored 'General case' 0 C--N 1.275 -2.646 0 N-CA-C 105.913 -1.884 . . . . 75.51 105.913 178.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . 0.401 ' HD3' ' OE1' ' A' ' 519' ' ' GLU . 49.2 ttt180 -152.62 141.28 20.9 Favored 'General case' 0 C--N 1.289 -2.023 0 C-N-CA 120.907 -0.317 . . . . 74.12 110.16 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 85.05 23.6 48.24 Favored Glycine 0 C--N 1.311 -0.827 0 N-CA-C 110.615 -0.994 . . . . 71.14 110.615 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.08 151.07 67.8 Favored Pre-proline 0 C--O 1.244 0.776 0 C-N-CA 123.974 0.91 . . . . 72.31 112.998 -176.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -61.45 151.91 76.53 Favored 'Trans proline' 0 N--CA 1.442 -1.509 0 C-N-CA 122.853 2.369 . . . . 72.22 110.642 173.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -77.68 92.23 4.11 Favored 'General case' 0 C--N 1.275 -2.634 0 CA-C-N 114.817 -1.083 . . . . 73.4 110.035 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.22 36.07 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.022 0 CA-C-N 112.226 -2.261 . . . . 43.41 112.456 174.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.66 124.49 19.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 107.717 -1.216 . . . . 65.44 107.717 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 8.6 p -76.13 150.27 37.24 Favored 'General case' 0 N--CA 1.399 -3.012 0 N-CA-C 109.123 -0.695 . . . . 65.43 109.123 -175.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.276 2.4 pp -61.7 -30.73 48.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 114.277 1.214 . . . . 74.42 114.277 -173.133 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . 0.428 ' N ' HD11 ' A' ' 458' ' ' ILE . 0.0 OUTLIER -81.56 -22.27 37.91 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.542 -0.863 . . . . 72.41 110.04 -177.7 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 20.6 t70 -75.67 -40.23 56.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.162 -0.926 . . . . 75.0 109.177 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 13.7 tt -76.0 -32.28 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 115.214 -0.903 . . . . 71.21 110.263 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 84.4 mt -72.14 -29.42 64.03 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.348 -0.612 . . . . 75.13 109.348 176.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 25.8 t70 -63.16 -53.39 54.1 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-N 115.324 -0.853 . . . . 61.43 108.784 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.81 -42.04 64.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 114.539 -1.21 . . . . 73.23 111.435 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.94 -37.16 78.7 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.828 -0.624 . . . . 53.32 110.982 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 77.36 -140.56 24.68 Favored Glycine 0 N--CA 1.421 -2.32 0 C-N-CA 120.42 -0.895 . . . . 71.12 112.153 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -48.63 -32.08 7.69 Favored 'General case' 0 C--N 1.291 -1.971 0 C-N-CA 126.238 1.815 . . . . 64.33 113.137 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -66.61 -23.44 66.18 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.965 0.412 . . . . 74.42 111.393 -177.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.93 -15.48 60.69 Favored 'General case' 0 C--O 1.206 -1.201 0 CA-C-N 116.136 -0.484 . . . . 63.44 111.532 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.8 m -78.08 -16.83 57.67 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-O 121.389 0.614 . . . . 75.32 110.387 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . 0.416 ' OD1' ' HB3' ' A' ' 495' ' ' MET . 11.7 t70 -84.69 -11.9 54.94 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 116.274 -0.421 . . . . 73.43 111.431 -175.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.1 tt -52.39 145.78 2.53 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 124.194 0.998 . . . . 71.12 111.889 -176.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . 0.414 ' O ' HG12 ' A' ' 472' ' ' ILE . 84.8 mtt180 -75.46 158.06 33.16 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.066 -1.087 . . . . 73.25 108.066 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 7.7 t -57.82 110.45 0.91 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-O 121.416 0.627 . . . . 72.21 111.065 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 62.29 27.01 16.18 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.57 1.148 . . . . 75.4 111.088 -176.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.63 19.11 2.06 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 115.276 0.87 . . . . 54.3 115.276 -176.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.5 p -93.61 110.6 23.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-O 121.536 0.684 . . . . 72.41 109.714 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -108.85 94.91 5.3 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.571 -1.27 . . . . 74.14 107.571 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' MET . . . . . 0.533 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 53.6 ttm -87.67 139.31 30.66 Favored 'General case' 0 C--N 1.287 -2.133 0 C-N-CA 120.394 -0.522 . . . . 53.41 109.73 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 66.3 t -81.67 97.85 3.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 N-CA-C 108.826 -0.805 . . . . 74.14 108.826 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.4 mt -97.26 154.02 17.67 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.369 -1.287 . . . . 73.51 107.83 178.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -93.32 173.44 7.71 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.391 -1.707 . . . . 74.34 106.391 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -59.35 -27.51 66.0 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 119.279 0.945 . . . . 74.11 111.724 -176.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -70.37 -11.84 61.18 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.746 0.819 . . . . 75.22 111.155 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 82.5 29.03 37.39 Favored Glycine 0 N--CA 1.432 -1.6 0 CA-C-N 116.131 -0.486 . . . . 37.65 112.412 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -123.1 140.24 33.18 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 108.437 -0.949 . . . . 71.45 108.437 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . 0.533 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 29.7 Cg_endo -63.51 134.23 43.63 Favored 'Trans proline' 0 C--O 1.242 0.707 0 C-N-CA 122.906 2.404 . . . . 64.03 113.727 -177.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 17.7 m -76.31 -18.58 58.88 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.735 0.779 . . . . 64.24 109.796 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 106.7 15.85 15.75 Favored Glycine 0 CA--C 1.497 -1.084 0 N-CA-C 111.172 -0.771 . . . . 71.53 111.172 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -127.42 151.85 48.28 Favored 'General case' 0 C--O 1.256 1.433 0 N-CA-C 105.412 -2.07 . . . . 61.35 105.412 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -165.21 153.95 12.09 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 118.153 0.433 . . . . 51.52 110.062 -177.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -125.69 120.13 29.85 Favored 'General case' 0 C--N 1.288 -2.101 0 N-CA-C 108.669 -0.863 . . . . 75.11 108.669 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 56.7 mt -107.66 130.18 60.42 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.53 0 N-CA-C 107.059 -1.459 . . . . 74.34 107.059 176.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . 0.476 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 9.3 tt0 -104.5 116.98 33.04 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.155 0.503 . . . . 75.41 110.155 -177.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' MET . . . . . 0.416 ' HB3' ' OD1' ' A' ' 471' ' ' ASP . 0.3 OUTLIER -92.79 172.59 8.25 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.197 -0.91 . . . . 72.22 110.192 178.09 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -88.16 -35.28 17.49 Favored 'General case' 0 N--CA 1.394 -3.253 0 CA-C-N 116.21 -0.45 . . . . 72.21 110.472 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.4 m -116.25 141.12 48.56 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-O 121.526 0.679 . . . . 61.44 112.085 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -73.03 -16.12 61.5 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.202 -0.908 . . . . 70.44 110.969 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -62.03 -56.38 19.57 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.654 -0.703 . . . . 75.21 109.686 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.27 70.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.082 -0.963 . . . . 74.45 111.243 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.17 -42.76 83.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.11 -0.496 . . . . 72.22 110.71 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -66.69 -44.48 81.62 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.072 0.463 . . . . 73.44 110.287 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 38.5 tpp -71.14 -33.32 69.96 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.75 -0.659 . . . . 74.5 110.991 -175.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.36 -40.55 81.43 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 109.647 -0.501 . . . . 71.11 109.647 176.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -69.41 -30.19 68.09 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.962 -0.563 . . . . 62.02 111.537 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -76.34 -40.78 50.4 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 120.811 -0.356 . . . . 74.24 110.509 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -69.88 -43.3 72.1 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.278 0.561 . . . . 61.25 110.63 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 61.0 m -99.35 16.75 22.03 Favored 'General case' 0 N--CA 1.415 -2.201 0 N-CA-C 113.529 0.937 . . . . 44.05 113.529 -173.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 10.9 t-80 -66.68 91.76 0.2 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.303 -0.559 . . . . 75.01 110.158 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 99.4 mttt 67.93 35.74 3.69 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 125.037 1.335 . . . . 63.52 110.758 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -80.35 147.77 30.93 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.614 -1.175 . . . . 74.13 109.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . 0.485 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 13.8 m120 -74.72 120.3 20.08 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 115.724 -0.671 . . . . 74.25 110.311 178.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.1 ttt -102.15 93.16 5.08 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 106.088 -1.819 . . . . 74.14 106.088 175.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 67.71 -77.38 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 124.297 1.039 . . . . 73.14 111.185 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -125.38 -18.49 5.31 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-O 121.811 0.815 . . . . 74.42 110.713 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 22.7 tpt180 -90.79 160.86 15.56 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.253 -0.885 . . . . 75.42 109.956 -170.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -113.91 116.26 28.99 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.29 -1.744 . . . . 74.54 106.29 172.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 92.9 t -110.86 122.0 64.57 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.921 0 CA-C-N 116.33 -0.396 . . . . 63.42 109.946 -176.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . 0.401 ' OE1' ' HD3' ' A' ' 450' ' ' ARG . 41.7 tt0 -85.71 109.46 18.63 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 107.891 -1.151 . . . . 75.23 107.891 176.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.5 t -105.02 124.65 59.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.295 -1.372 . . . . 54.5 107.295 176.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -133.4 138.28 46.2 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.44 -0.948 . . . . 53.02 108.44 -173.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . 0.401 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 46.4 tt0 -83.16 153.25 24.88 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.626 -0.509 . . . . 73.41 109.626 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . 0.401 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 5.9 p -162.66 171.5 16.79 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 122.769 0.428 . . . . 74.42 110.004 -177.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.539 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 1.3 m -97.59 160.47 14.3 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.7 -0.682 . . . . 73.35 109.429 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.88 -21.71 61.38 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.629 -0.714 . . . . 71.42 111.535 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.39 -54.1 23.46 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 116.343 -0.39 . . . . 72.03 110.372 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -38.51 82.7 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 110.215 -0.291 . . . . 75.31 110.215 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -59.35 -44.77 92.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.857 -0.61 . . . . 72.41 110.445 177.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -69.32 -40.67 77.49 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.315 0.579 . . . . 71.53 109.567 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -59.62 -44.53 93.42 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.221 -0.899 . . . . 74.22 111.271 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.4 t -73.65 -34.6 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 120.38 -0.528 . . . . 61.04 110.377 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 79.3 mt . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 75.44 111.443 178.836 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.241 0.647 0 N-CA-C 109.672 -0.492 . . . . 72.22 109.672 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.513 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 19.8 ptt85 -92.35 65.72 4.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.168 0.985 . . . . 74.22 111.401 177.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 33.2 p30 -112.75 12.11 19.55 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.294 -0.866 . . . . 74.41 110.408 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 30.7 m -109.18 145.77 35.25 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 108.752 -0.833 . . . . 62.13 108.752 -177.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.72 140.07 49.99 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.111 0 N-CA-C 108.248 -1.019 . . . . 55.25 108.248 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -111.6 121.69 45.83 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.07 -1.085 . . . . 70.41 108.07 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.9 mt -103.41 132.18 49.88 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 106.488 -1.671 . . . . 75.43 106.488 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -126.86 136.61 52.58 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 118.419 0.554 . . . . 55.35 109.621 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 96.09 38.86 4.46 Favored Glycine 0 C--N 1.31 -0.885 0 C-N-CA 120.489 -0.862 . . . . 41.22 111.654 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.1 mt -83.54 144.33 45.78 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.991 -0.374 . . . . 70.44 109.991 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . 0.416 ' HB2' ' HB3' ' A' ' 456' ' ' ALA . 31.8 Cg_exo -50.15 143.96 24.0 Favored 'Trans proline' 0 C--O 1.253 1.266 0 C-N-CA 123.113 2.542 . . . . 62.53 111.065 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -70.88 92.6 0.92 Allowed 'General case' 0 N--CA 1.417 -2.081 0 CA-C-O 122.402 1.096 . . . . 74.14 111.469 -177.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.87 33.62 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 111.162 -2.744 . . . . 75.34 112.415 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . 0.416 ' HB3' ' HB2' ' A' ' 453' ' ' PRO . . . -56.01 138.42 49.16 Favored 'General case' 0 C--O 1.246 0.883 0 N-CA-C 109.44 -0.578 . . . . 54.13 109.44 171.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 28.4 p -78.06 160.22 28.23 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 116.42 -0.354 . . . . 74.31 111.02 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.464 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 65.4 mt -65.34 -31.93 56.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.262 0.554 . . . . 63.1 109.601 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -64.01 -40.2 95.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.052 0.453 . . . . 54.31 110.249 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -70.16 -37.83 75.29 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.428 -0.806 . . . . 73.11 110.161 -176.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.431 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.4 tt -74.59 -32.01 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.027 -0.533 . . . . 75.11 110.651 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -67.31 -35.38 79.32 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.451 0.643 . . . . 53.43 110.001 176.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -65.13 -49.02 71.51 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.621 -0.881 . . . . 64.35 108.621 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -53.73 -41.92 67.58 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 113.894 -1.503 . . . . 75.13 111.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.88 -36.68 84.72 Favored 'General case' 0 C--O 1.248 0.998 0 CA-C-N 116.129 -0.487 . . . . 74.43 111.718 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 84.11 -143.18 21.06 Favored Glycine 0 N--CA 1.422 -2.29 0 C-N-CA 120.099 -1.048 . . . . 61.21 111.706 -178.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -54.52 -34.27 61.43 Favored 'General case' 0 C--N 1.3 -1.561 0 C-N-CA 123.527 0.731 . . . . 65.22 111.066 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . 0.428 ' O ' ' HE1' ' A' ' 495' ' ' MET . 95.0 m-85 -61.3 -17.45 53.71 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.559 -0.746 . . . . 73.14 112.599 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . 0.473 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -68.25 -15.29 63.52 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 120.836 0.35 . . . . 65.24 111.397 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 17.3 m -84.77 -20.53 30.88 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-O 121.894 0.854 . . . . 73.21 109.194 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 496' ' ' LYS . 35.4 m-20 -107.43 15.52 24.8 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.362 -0.835 . . . . 70.04 112.365 -174.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . 0.473 HG22 ' O ' ' A' ' 469' ' ' ALA . 11.6 tt -82.55 151.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 106.316 -1.735 . . . . 65.0 106.316 170.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 20.8 mtm-85 -100.3 153.76 19.04 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 118.975 -1.09 . . . . 61.14 111.128 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 10.0 t -62.58 136.27 57.81 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.566 -0.901 . . . . 73.34 108.566 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 67.9 22.83 8.54 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 122.294 1.045 . . . . 72.22 109.376 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -88.08 -20.46 49.54 Favored Glycine 0 N--CA 1.423 -2.224 0 C-N-CA 120.701 -0.762 . . . . 62.52 112.853 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 47.8 t -89.66 115.19 28.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 117.011 0.406 . . . . 72.23 110.988 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -127.65 98.09 5.08 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.881 -0.785 . . . . 75.22 108.881 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 86.0 mtp -83.9 139.44 32.61 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.849 -0.426 . . . . 75.31 109.849 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 43.0 t -84.04 97.98 5.33 Favored 'Isoleucine or valine' 0 C--O 1.251 1.171 0 CA-C-O 121.553 0.692 . . . . 71.14 109.728 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 65.2 mt -86.14 155.95 20.55 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.885 -1.154 . . . . 71.52 107.885 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -96.26 -178.67 4.39 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.583 -1.636 . . . . 72.33 106.583 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 47.5 m-70 -65.62 -9.81 30.21 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 119.022 0.828 . . . . 74.35 112.235 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . 0.435 ' OE1' ' HD3' ' A' ' 486' ' ' ARG . 35.2 tt0 -81.38 -12.79 58.86 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 123.855 0.862 . . . . 53.44 108.877 176.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 75.33 29.19 60.49 Favored Glycine 0 CA--C 1.494 -1.242 0 CA-C-N 115.275 -0.875 . . . . 62.33 111.373 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . 0.435 ' HD3' ' OE1' ' A' ' 484' ' ' GLN . 62.1 mtp85 -133.16 147.96 67.29 Favored Pre-proline 0 C--N 1.308 -1.238 0 N-CA-C 107.945 -1.132 . . . . 64.35 107.945 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -54.93 134.47 63.57 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 123.734 2.956 . . . . 53.14 115.061 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.7 m -75.48 -33.98 60.86 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.176 -0.92 . . . . 75.24 108.884 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 137.16 -16.35 3.66 Favored Glycine 0 CA--C 1.493 -1.309 0 N-CA-C 110.806 -0.917 . . . . 54.21 110.806 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -116.4 158.7 23.09 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-O 121.021 0.439 . . . . 74.31 110.554 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.33 167.69 29.54 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.687 -0.688 . . . . 55.03 109.53 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . 0.478 ' HB3' ' HE3' ' A' ' 528' ' ' MET . 91.2 m-85 -120.08 145.2 47.1 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.064 -0.717 . . . . 72.34 109.064 176.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 46.5 mt -133.44 131.89 57.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 N-CA-C 107.665 -1.235 . . . . 74.24 107.665 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . 0.411 ' HB2' ' HE1' ' A' ' 528' ' ' MET . 59.7 tt0 -106.47 124.47 49.65 Favored 'General case' 0 C--N 1.284 -2.269 0 CA-C-O 121.477 0.655 . . . . 74.45 109.997 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' MET . . . . . 0.428 ' HE1' ' O ' ' A' ' 468' ' ' PHE . 96.3 mmm -98.08 170.05 9.18 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.79 -1.095 . . . . 72.11 110.994 -175.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 471' ' ' ASP . 84.3 tttt -65.3 -46.39 80.58 Favored 'General case' 0 C--N 1.28 -2.432 0 C-N-CA 125.894 1.678 . . . . 71.34 111.738 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.7 m -130.22 142.61 50.55 Favored 'General case' 0 N--CA 1.408 -2.545 0 N-CA-C 108.617 -0.883 . . . . 70.31 108.617 -172.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.83 74.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.97 0.89 . . . . 75.12 111.126 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.84 -46.1 66.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 114.294 -1.321 . . . . 74.24 110.17 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -62.28 -38.26 88.66 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.821 -1.081 . . . . 72.21 110.293 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.34 -37.93 88.59 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.393 -0.821 . . . . 74.23 111.204 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.71 -41.46 83.51 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 110.045 -0.354 . . . . 61.22 110.045 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 54.8 ttm -67.81 -38.93 83.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.301 -0.408 . . . . 62.2 110.224 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.23 86.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.97 -0.559 . . . . 64.43 110.354 177.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.03 84.32 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.979 -0.555 . . . . 63.41 110.894 177.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -64.83 -42.09 95.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.702 -0.481 . . . . 74.12 109.702 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.05 -45.29 94.2 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.411 0.624 . . . . 65.51 111.105 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.7 m -94.45 6.75 47.81 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 112.848 0.684 . . . . 61.12 112.848 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -76.05 108.35 8.9 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.342 -0.849 . . . . 72.42 108.792 175.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 44.0 mttp 72.8 17.32 4.39 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.233 1.013 . . . . 64.35 112.066 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.17 138.27 36.84 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 115.894 -0.593 . . . . 73.34 109.801 -178.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -76.11 136.08 39.85 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 115.038 -0.983 . . . . 63.34 111.994 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.4 ttt -129.8 103.25 6.7 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 105.519 -2.03 . . . . 73.25 105.519 175.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 71.3 -78.89 0.04 OUTLIER 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.708 1.203 . . . . 63.21 110.698 -175.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -138.63 -14.79 1.23 Allowed 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.579 0.704 . . . . 64.01 111.843 176.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -92.23 156.46 17.28 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.891 -1.151 . . . . 75.51 107.891 -175.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -109.66 118.84 37.62 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-O 121.492 0.663 . . . . 73.02 109.321 173.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.9 t -92.35 131.23 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.262 0 N-CA-C 107.855 -1.165 . . . . 73.32 107.855 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -104.94 113.6 27.3 Favored 'General case' 0 N--CA 1.413 -2.31 0 N-CA-C 108.997 -0.742 . . . . 72.22 108.997 175.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 76.0 t -104.08 129.77 55.78 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.606 -1.179 . . . . 71.42 111.196 -177.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -127.57 141.94 51.5 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.281 -0.872 . . . . 73.44 109.076 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -84.0 151.92 24.73 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 117.958 0.345 . . . . 73.22 111.509 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.4 p -155.31 173.23 16.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 123.621 0.768 . . . . 62.53 109.746 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.5 p -102.13 159.59 15.25 Favored 'General case' 0 C--N 1.284 -2.266 0 N-CA-C 112.705 0.631 . . . . 71.41 112.705 -179.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.34 -37.62 67.69 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 123.871 0.869 . . . . 75.21 112.086 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.94 -35.64 81.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.997 -0.547 . . . . 75.15 110.713 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.73 -39.77 84.25 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 123.345 0.403 . . . . 61.11 110.568 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' MET . . . . . 0.534 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 42.6 ttm -59.58 -48.45 81.6 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.181 -0.674 . . . . 55.4 109.181 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.38 -35.49 80.56 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.069 -0.969 . . . . 74.44 110.203 -179.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -65.76 -42.3 91.02 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.657 -0.701 . . . . 73.23 110.153 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 88.1 t -72.58 -34.14 46.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 120.932 0.396 . . . . 71.24 110.5 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.9 mt . . . . . 0 CA--C 1.534 0.346 0 CA-C-O 121.187 0.518 . . . . 71.24 110.061 176.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.244 0.778 0 N-CA-C 108.536 -0.913 . . . . 62.41 108.536 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.527 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 26.7 mtp180 -90.82 73.8 6.57 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-O 121.846 0.832 . . . . 75.43 109.72 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 26.4 p-10 -114.68 14.06 17.48 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 115.011 -0.995 . . . . 71.25 109.87 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 25.4 m -116.3 149.66 38.91 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 107.628 -1.249 . . . . 75.33 107.628 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -124.34 139.33 50.98 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.449 0 N-CA-C 108.935 -0.765 . . . . 74.22 108.935 -177.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -109.97 123.49 49.75 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.083 -1.081 . . . . 64.21 108.083 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 18.2 mt -99.83 144.36 28.98 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 106.979 -1.489 . . . . 73.24 106.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -141.28 140.0 33.79 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.545 -0.909 . . . . 72.34 108.545 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 84.06 32.03 24.46 Favored Glycine 0 C--N 1.291 -1.948 0 C-N-CA 120.315 -0.945 . . . . 74.53 111.727 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.1 138.35 89.75 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 115.981 -0.109 . . . . 74.01 110.852 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -58.25 144.97 94.95 Favored 'Trans proline' 0 CA--C 1.486 -1.914 0 C-N-CA 122.549 2.166 . . . . 73.52 111.31 176.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -78.14 106.69 10.19 Favored 'General case' 1 N--CA 1.376 -4.144 0 N-CA-C 106.908 -1.516 . . . . 73.32 106.908 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.97 29.61 0.02 OUTLIER 'General case' 0 C--N 1.267 -2.986 0 CA-C-N 111.91 -2.404 . . . . 62.15 112.841 173.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -87.3 120.03 28.17 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.317 -1.364 . . . . 64.11 107.317 169.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' THR . . . . . 0.574 ' HB ' ' OE1' ' A' ' 459' ' ' GLU . 20.1 p -74.39 157.24 36.02 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.389 0.138 . . . . 64.53 110.917 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.437 ' HA ' HG21 ' A' ' 461' ' ' ILE . 2.7 pp -65.34 -25.0 36.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 CA-C-O 121.19 0.519 . . . . 73.12 112.093 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . 0.574 ' OE1' ' HB ' ' A' ' 457' ' ' THR . 6.3 mp0 -68.21 -33.75 74.98 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.01 -0.737 . . . . 54.44 109.01 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -77.18 -34.1 56.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.21 -0.905 . . . . 64.04 109.646 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 465' ' ' LEU . 13.4 tt -78.74 -32.2 15.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.983 0 C-N-CA 120.092 -0.643 . . . . 73.34 111.062 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.82 -30.82 71.1 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.939 -0.476 . . . . 72.22 110.866 175.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -63.79 -53.28 53.35 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.944 -1.132 . . . . 61.23 107.944 172.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . 0.406 ' HB3' ' O ' ' A' ' 461' ' ' ILE . 80.1 t80 -51.92 -41.97 62.41 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 113.297 -1.774 . . . . 72.1 111.727 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 91.3 mt -64.65 -37.3 87.12 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.725 -0.67 . . . . 75.12 111.565 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 90.4 -141.85 16.08 Favored Glycine 0 N--CA 1.419 -2.496 0 C-N-CA 120.255 -0.974 . . . . 41.51 112.253 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.56 -27.88 12.26 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 124.852 1.261 . . . . 62.32 112.186 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -64.63 -13.53 54.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.591 . . . . 72.42 112.418 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -67.36 -19.92 65.49 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.105 0.478 . . . . 72.02 111.176 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.2 m -101.71 0.46 36.04 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-O 121.968 0.89 . . . . 64.32 109.811 176.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . 0.414 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 58.6 m-20 -108.56 6.14 25.72 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 121.816 -0.552 . . . . 63.1 112.333 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 7.6 tt -88.74 151.71 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.791 0 N-CA-C 107.61 -1.256 . . . . 43.31 107.61 174.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 42.5 ptt85 -78.02 161.88 27.15 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 118.48 -1.288 . . . . 63.3 109.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 32.7 m -66.69 115.87 6.99 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 115.589 -0.732 . . . . 74.31 110.483 -175.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 65.44 28.81 11.55 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.616 1.166 . . . . 74.32 109.741 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -80.0 8.22 52.01 Favored Glycine 0 N--CA 1.442 -0.902 0 CA-C-N 115.448 -0.796 . . . . 62.33 114.392 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.96 118.85 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.812 -0.811 . . . . 62.34 108.812 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -117.18 135.35 53.84 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 107.34 -1.356 . . . . 65.2 107.34 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 52.7 tpp -116.05 138.52 51.15 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 108.861 -0.792 . . . . 62.22 108.861 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.05 106.01 16.03 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.128 0 N-CA-C 108.327 -0.99 . . . . 43.45 108.327 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 60.1 mt -89.8 147.39 23.83 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 106.344 -1.725 . . . . 73.33 106.344 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -90.33 -169.38 2.39 Favored 'General case' 0 C--N 1.27 -2.882 0 CA-C-N 115.919 -0.582 . . . . 51.3 109.915 -176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -62.64 -29.06 70.34 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.526 0.679 . . . . 71.14 110.362 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -79.99 -7.0 58.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.542 -0.753 . . . . 74.31 110.55 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . 0.446 ' C ' ' HD2' ' A' ' 486' ' ' ARG . . . 79.36 21.88 66.22 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 116.263 -0.426 . . . . 71.03 113.075 176.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . 0.446 ' HD2' ' C ' ' A' ' 485' ' ' GLY . 8.5 mpt_? -120.31 151.32 53.29 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 108.667 -0.864 . . . . 73.33 108.667 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.15 123.38 13.7 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.467 2.112 . . . . 72.31 112.574 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 13.0 m -74.92 -8.35 56.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.689 -0.687 . . . . 71.33 111.004 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 87.74 16.43 59.92 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.368 -1.093 . . . . 42.41 110.368 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -125.56 132.78 52.5 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 103.968 -2.605 . . . . 54.22 103.968 -178.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -148.56 167.08 26.34 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 118.381 0.537 . . . . 53.5 110.42 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 85.4 m-85 -135.48 120.59 18.82 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 123.231 0.612 . . . . 74.33 109.606 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.4 mt -110.54 131.96 60.23 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 108.054 -1.091 . . . . 71.14 108.054 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -103.91 124.78 49.59 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 108.568 -0.901 . . . . 71.13 108.568 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 91.1 mmm -98.7 175.05 6.12 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.272 0.558 . . . . 73.25 111.304 -174.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -71.8 -34.77 69.66 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 124.933 1.293 . . . . 60.42 110.55 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 30.6 t -152.18 153.59 34.14 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 115.007 -0.997 . . . . 75.25 109.962 -172.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.2 75.36 Favored 'General case' 0 CA--C 1.508 -0.673 0 C-N-CA 123.814 0.846 . . . . 71.43 110.815 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -59.09 -48.23 82.37 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 122.488 1.137 . . . . 64.22 109.959 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . 0.414 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 1.5 mmp_? -65.7 -40.98 92.86 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 113.227 -1.806 . . . . 74.34 109.832 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.97 -40.99 87.59 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.281 -0.872 . . . . 73.32 110.581 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -66.12 -38.35 87.97 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.647 -0.706 . . . . 74.34 110.93 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 83.8 mtp -75.63 -36.31 60.24 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 119.482 -0.887 . . . . 64.02 110.965 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.22 -41.1 90.56 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.283 -0.417 . . . . 75.22 110.596 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.76 -36.18 80.06 Favored 'General case' 0 C--O 1.203 -1.371 0 CA-C-N 116.067 -0.515 . . . . 55.24 110.38 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -44.72 82.06 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.477 -0.329 . . . . 75.14 110.898 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -63.45 -43.55 97.07 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.668 0.605 . . . . 73.21 111.369 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.8 m -101.67 10.99 39.6 Favored 'General case' 0 N--CA 1.432 -1.354 0 N-CA-C 112.726 0.639 . . . . 54.05 112.726 -173.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . 0.455 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 44.0 t60 -70.4 97.56 1.29 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 119.853 -0.739 . . . . 75.33 109.206 176.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 66.4 66.24 0.47 Allowed 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 125.156 1.383 . . . . 74.12 110.203 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.3 tptt -112.79 140.81 47.26 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.323 -1.762 . . . . 72.43 108.818 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -86.32 132.46 33.97 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 120.211 -0.596 . . . . 72.41 110.596 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.3 ttt -118.26 88.66 2.96 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 106.13 -1.804 . . . . 72.21 106.13 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt 68.99 -83.52 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.059 -1.428 . . . . 74.01 113.01 -176.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -121.87 -9.77 8.76 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.393 0.616 . . . . 73.11 110.833 -173.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -115.24 156.65 24.99 Favored 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 108.518 -0.919 . . . . 71.45 108.518 -173.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -108.85 121.45 45.11 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 121.112 0.482 . . . . 73.13 109.787 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 60.5 t -102.9 114.04 41.34 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.951 0 CA-C-N 114.53 -1.214 . . . . 74.43 108.153 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -104.51 110.37 22.62 Favored 'General case' 0 C--N 1.279 -2.497 0 N-CA-C 107.625 -1.25 . . . . 65.42 107.625 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 73.5 t -104.82 129.02 58.04 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 CA-C-N 115.709 -0.678 . . . . 63.42 111.336 -175.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -116.06 152.11 34.23 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.325 -0.991 . . . . 75.32 108.325 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -90.99 157.81 17.07 Favored 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 106.835 -1.542 . . . . 74.13 106.835 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -157.69 160.51 38.03 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.405 0.622 . . . . 71.42 112.422 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 38.1 t -86.09 150.83 24.16 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.727 -1.124 . . . . 71.4 109.037 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.01 -30.03 67.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.208 0.528 . . . . 72.44 110.189 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -65.85 -51.47 58.6 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.56 1.144 . . . . 75.13 109.572 176.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -64.81 -37.48 87.76 Favored 'General case' 0 C--N 1.297 -1.69 0 C-N-CA 126.067 1.747 . . . . 73.01 109.798 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' MET . . . . . 0.432 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.2 ttt -67.03 -44.63 79.76 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.315 -0.857 . . . . 70.41 109.566 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -65.57 -38.11 88.6 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.874 -0.603 . . . . 61.43 109.779 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -59.31 -45.88 90.1 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.43 -0.805 . . . . 74.3 110.742 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 60.4 t -68.89 -39.65 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 120.18 -0.608 . . . . 74.51 110.326 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.5 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.489 . . . . 71.14 112.22 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 36.6 t . . . . . 0 C--O 1.249 1.067 0 N-CA-C 107.712 -1.218 . . . . 63.45 107.712 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.497 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.6 mtm180 -88.1 75.76 8.63 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 108.507 -0.923 . . . . 72.44 108.507 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -116.18 11.17 15.12 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.173 -1.376 . . . . 75.4 112.196 -171.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.413 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 56.6 m -106.63 152.43 23.76 Favored 'General case' 0 N--CA 1.407 -2.575 0 C-N-CA 119.547 -0.861 . . . . 65.43 109.464 -176.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -122.26 140.13 47.09 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.109 0 N-CA-C 106.495 -1.669 . . . . 75.35 106.495 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . 0.534 ' HD3' ' NH2' ' A' ' 450' ' ' ARG . 20.1 ttm180 -115.4 125.45 53.17 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.052 -0.722 . . . . 61.41 109.052 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 8.7 mt -107.12 145.66 32.22 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 107.647 -1.242 . . . . 62.21 107.647 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . 0.534 ' NH2' ' HD3' ' A' ' 448' ' ' ARG . 2.7 ptp180 -149.31 130.81 14.82 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 121.08 0.467 . . . . 75.25 111.706 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 111.02 29.95 3.35 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.407 -0.815 . . . . 38.31 111.094 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 91.4 mt -70.6 133.12 86.93 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 111.665 0.246 . . . . 75.41 111.665 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . 0.493 ' HA ' ' CZ ' ' A' ' 516' ' ' ARG . 31.3 Cg_exo -58.58 164.64 9.0 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 123.305 2.67 . . . . 72.35 113.389 175.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -77.47 100.15 5.91 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.964 -1.471 . . . . 73.02 108.179 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.61 32.62 0.02 OUTLIER 'General case' 0 C--N 1.277 -2.544 0 CA-C-N 111.756 -2.475 . . . . 73.12 111.421 173.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.85 113.62 3.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.024 -1.102 . . . . 73.41 108.024 171.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 72.8 p -84.26 170.47 13.67 Favored 'General case' 0 N--CA 1.426 -1.642 0 CA-C-O 120.98 0.419 . . . . 62.33 112.048 -173.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.578 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 35.9 pt -63.68 -24.85 36.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.689 -0.687 . . . . 70.25 110.255 174.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.86 -43.04 37.66 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.254 -0.647 . . . . 74.43 109.254 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 7.9 t70 -69.64 -32.29 70.88 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.286 -0.87 . . . . 74.13 109.845 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.415 HG23 ' O ' ' A' ' 458' ' ' ILE . 11.7 tt -74.53 -29.02 23.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 C-N-CA 120.293 -0.563 . . . . 73.21 110.288 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 85.6 mt -65.45 -36.06 82.76 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.564 -0.532 . . . . 70.4 109.564 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . 0.528 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 22.6 t70 -57.38 -56.23 24.48 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.371 -0.831 . . . . 71.13 109.074 171.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -53.3 -40.47 64.77 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 113.506 -1.679 . . . . 71.25 111.82 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 82.3 mt -73.26 -37.29 66.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.654 -0.703 . . . . 64.55 112.357 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.49 -137.16 39.62 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 119.762 -1.209 . . . . 72.54 112.09 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -57.43 -21.89 39.69 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 124.632 1.173 . . . . 73.43 112.354 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -69.39 -10.14 56.62 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.372 0.508 . . . . 71.22 112.372 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -65.98 -15.22 62.81 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.353 0.597 . . . . 73.23 110.933 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 13.9 m -87.54 -14.87 39.07 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-O 121.115 0.483 . . . . 64.21 111.014 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.2 6.69 20.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.64 0.978 . . . . 64.44 113.64 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 8.9 tt -90.58 151.47 3.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 N-CA-C 108.524 -0.917 . . . . 74.33 108.524 175.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -78.78 148.18 33.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.093 -0.706 . . . . 73.33 109.093 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 29.1 m -51.43 109.97 0.4 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.359 1.064 . . . . 64.34 112.777 -175.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 34.6 m170 64.13 28.68 14.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.509 1.124 . . . . 73.42 110.707 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.42 20.58 8.57 Favored Glycine 0 N--CA 1.43 -1.74 0 CA-C-N 114.986 -1.006 . . . . 42.2 113.453 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.83 106.15 17.57 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 N-CA-C 106.67 -1.604 . . . . 64.42 106.67 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -114.35 93.27 4.27 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 109.153 -0.684 . . . . 74.44 109.153 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -83.82 142.68 30.46 Favored 'General case' 0 C--N 1.294 -1.844 0 C-N-CA 120.564 -0.455 . . . . 64.33 109.935 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 57.3 t -76.74 124.92 35.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 106.581 -1.637 . . . . 74.1 106.581 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.23 154.95 18.55 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.16 0.505 . . . . 70.33 109.996 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -96.04 172.02 8.26 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 105.775 -1.935 . . . . 71.33 105.775 176.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -65.51 -5.18 7.22 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.693 0.997 . . . . 65.53 113.693 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . 0.462 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 36.2 tt0 -92.56 -1.11 57.17 Favored 'General case' 0 CA--C 1.555 1.17 0 CA-C-O 121.984 0.897 . . . . 70.23 109.25 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.19 30.65 62.56 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.629 -0.714 . . . . 65.14 112.83 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . 0.462 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 93.9 mtt180 -127.81 148.6 67.7 Favored Pre-proline 0 C--N 1.306 -1.287 0 N-CA-C 107.905 -1.146 . . . . 73.34 107.905 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.92 133.45 54.82 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.08 2.52 . . . . 54.42 113.531 -177.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.9 m -73.73 -17.91 61.06 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 123.888 0.875 . . . . 73.1 111.165 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 118.02 -20.14 10.79 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 110.444 -1.062 . . . . 64.12 110.444 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -108.33 148.52 29.94 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 106.543 -1.651 . . . . 70.01 106.543 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -159.71 171.13 20.1 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 117.903 0.32 . . . . 55.04 110.803 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . 0.451 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 98.3 m-85 -128.55 151.08 49.85 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.605 -0.725 . . . . 64.04 109.511 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 50.7 mt -131.14 137.41 55.78 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.737 0 N-CA-C 105.849 -1.908 . . . . 62.55 105.849 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -110.72 115.89 30.35 Favored 'General case' 0 C--N 1.276 -2.622 0 C-N-CA 119.197 -1.001 . . . . 74.24 109.223 177.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 3.2 tpt -92.73 167.09 12.11 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.718 -1.128 . . . . 64.34 108.996 -172.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -53.24 -45.45 68.75 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.95 1.3 . . . . 75.21 112.295 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 22.6 m -147.65 168.4 22.14 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.282 -0.872 . . . . 73.52 110.0 -173.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.47 93.86 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 123.863 0.727 . . . . 73.53 111.911 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -69.2 -37.69 78.22 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 108.912 -0.773 . . . . 73.43 108.912 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -47.75 83.45 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.228 -1.351 . . . . 71.4 110.2 175.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -64.02 -39.06 93.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 65.11 110.495 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.75 -44.87 95.07 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.653 -0.703 . . . . 74.21 110.878 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 26.4 ttt -69.0 -37.23 78.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.146 -0.479 . . . . 73.23 110.18 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.99 83.17 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.81 -0.632 . . . . 65.41 110.515 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.85 -38.96 87.38 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.191 -0.458 . . . . 72.2 110.65 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -66.91 -41.4 87.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.12 0.486 . . . . 51.33 109.987 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -64.34 -40.26 95.53 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.578 -0.737 . . . . 72.24 111.36 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 22.9 m -107.86 13.77 26.02 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 113.252 0.834 . . . . 71.23 113.252 -173.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -67.89 98.29 0.73 Allowed 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.884 -0.51 . . . . 74.04 109.714 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 85.8 tttt 66.09 54.5 0.98 Allowed 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.95 1.3 . . . . 72.43 109.604 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -93.26 140.35 29.63 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.701 -1.59 . . . . 60.12 109.023 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -84.7 113.7 21.49 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-O 121.077 0.465 . . . . 75.31 109.815 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 23.9 ttt -94.41 93.3 7.59 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 105.345 -2.094 . . . . 61.44 105.345 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 13.3 mptt 68.1 -82.26 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.871 -1.059 . . . . 72.05 111.333 -173.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -131.77 0.45 3.93 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 112.077 0.399 . . . . 71.42 112.077 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . 0.493 ' CZ ' ' HA ' ' A' ' 453' ' ' PRO . 15.8 ttm180 -118.49 146.54 44.44 Favored 'General case' 0 C--N 1.298 -1.671 0 C-N-CA 119.848 -0.741 . . . . 63.03 109.166 -176.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -89.59 120.76 31.17 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 109.111 -0.7 . . . . 74.33 109.111 -177.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 71.2 t -107.39 115.11 47.95 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.825 0 N-CA-C 107.246 -1.391 . . . . 75.4 107.246 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -94.19 112.75 24.59 Favored 'General case' 0 C--N 1.285 -2.21 0 N-CA-C 108.287 -1.005 . . . . 74.21 108.287 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -105.2 128.7 58.89 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.084 0 CA-C-N 115.439 -0.801 . . . . 63.42 110.373 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -128.83 159.55 35.39 Favored 'General case' 0 C--O 1.211 -0.924 0 C-N-CA 123.309 0.643 . . . . 71.34 109.302 -178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.22 143.92 25.79 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.401 -0.592 . . . . 72.4 109.401 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 7.3 p -141.6 171.1 14.52 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 122.872 0.469 . . . . 61.45 111.4 -177.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.9 m -98.64 144.89 27.43 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 115.698 -0.683 . . . . 74.44 111.261 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . 0.413 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -62.84 -31.91 73.02 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.817 0.673 . . . . 75.44 112.817 -177.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.69 -41.12 92.79 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.943 0.402 . . . . 74.14 110.469 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -72.2 -39.03 68.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.394 0.616 . . . . 71.44 109.358 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -62.66 -44.04 97.28 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.1 -0.954 . . . . 73.43 109.71 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.48 -30.29 68.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.198 0.523 . . . . 64.52 110.411 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -65.71 -45.2 83.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.616 -0.72 . . . . 72.42 109.575 178.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 58.3 t -67.02 -38.62 81.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.98 -0.555 . . . . 63.22 110.08 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 65.5 mt . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 121.013 0.435 . . . . 75.3 111.487 178.384 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . 0.465 ' HB ' ' OD2' ' A' ' 445' ' ' ASP . 25.5 t . . . . . 0 C--O 1.242 0.689 0 N-CA-C 107.273 -1.38 . . . . 73.15 107.273 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.527 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.0 mtp85 -84.63 52.53 2.41 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 122.154 0.978 . . . . 75.32 109.731 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . 0.465 ' OD2' ' HB ' ' A' ' 443' ' ' VAL . 3.3 p30 -101.65 2.47 38.79 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.801 -1.091 . . . . 71.11 111.023 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 23.3 m -110.96 141.31 44.58 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 118.869 -1.132 . . . . 40.11 109.012 -174.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . 0.406 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.4 mt -120.62 144.17 30.32 Favored 'Isoleucine or valine' 0 C--N 1.26 -3.318 0 N-CA-C 107.704 -1.221 . . . . 70.21 107.704 -177.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . 0.539 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 28.0 ttp180 -119.67 124.97 47.57 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.333 0.587 . . . . 73.13 109.815 173.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 8.6 mt -93.75 133.54 37.02 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 105.907 -1.886 . . . . 75.33 105.907 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . 0.453 ' C ' ' HD3' ' A' ' 450' ' ' ARG . 2.0 tmt_? -128.17 130.96 48.87 Favored 'General case' 0 C--N 1.277 -2.586 0 CA-C-O 121.221 0.534 . . . . 74.01 109.667 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . 0.426 ' O ' HG21 ' A' ' 518' ' ' VAL . . . 95.48 47.92 2.46 Favored Glycine 0 C--N 1.283 -2.365 0 N-CA-C 110.248 -1.141 . . . . 36.48 110.248 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 83.3 mt -72.63 148.69 90.34 Favored Pre-proline 0 C--N 1.312 -1.035 0 N-CA-C 111.763 0.282 . . . . 73.42 111.763 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.04 179.35 0.8 Allowed 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.701 2.267 . . . . 65.23 111.161 173.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -77.74 87.61 3.99 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 115.527 -0.761 . . . . 74.34 111.631 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 63.88 41.83 6.44 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 113.045 -1.889 . . . . 73.24 111.427 169.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -50.0 125.28 11.71 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 114.999 -1.0 . . . . 71.23 108.414 171.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 1.6 p -72.24 162.46 29.44 Favored 'General case' 0 N--CA 1.419 -1.99 0 N-CA-C 113.409 0.892 . . . . 73.12 113.409 -170.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.46 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.1 pt -60.25 -27.54 39.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 113.871 1.063 . . . . 73.34 113.871 -172.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.77 -26.68 34.25 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.129 -1.028 . . . . 74.11 110.38 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . 0.587 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 5.2 t70 -78.34 -28.48 47.24 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.019 -0.537 . . . . 75.14 110.462 -178.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 458' ' ' ILE . 15.4 tt -70.18 -32.04 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 C-N-CA 119.617 -0.833 . . . . 73.1 108.832 175.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 88.3 mt -70.71 -36.07 73.05 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.311 0.577 . . . . 72.32 109.507 176.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . 0.587 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 6.3 t70 -55.48 -55.96 25.8 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.746 -1.115 . . . . 73.45 108.825 173.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 113.749 -1.569 . . . . 75.15 111.598 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 57.9 mt -67.42 -29.96 69.59 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 113.062 0.764 . . . . 72.23 113.062 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.95 -137.92 26.15 Favored Glycine 0 N--CA 1.425 -2.066 0 C-N-CA 119.161 -1.495 . . . . 36.48 111.72 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -58.09 -28.12 64.3 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.699 -0.75 . . . . 63.22 112.372 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -70.67 -11.2 60.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.24 0.459 . . . . 72.25 112.24 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -64.44 -22.22 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.175 0.805 . . . . 71.4 113.175 -176.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 11.7 t -101.7 -3.15 28.71 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.618 0.723 . . . . 71.03 110.49 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.99 3.27 41.42 Favored 'General case' 0 C--O 1.245 0.841 0 CA-C-O 121.235 0.541 . . . . 72.5 111.319 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 10.4 tt -75.49 148.49 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.287 0 N-CA-C 107.627 -1.249 . . . . 75.23 107.627 173.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 62.2 mtm180 -79.38 164.85 23.7 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 120.113 -0.635 . . . . 75.41 110.967 176.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 8.8 m -52.87 107.12 0.2 Allowed 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.973 0.909 . . . . 71.44 112.128 -174.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 60.88 27.7 17.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.119 0.968 . . . . 70.42 111.629 177.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -72.85 -1.45 55.0 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.106 -0.952 . . . . 43.01 114.576 -176.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.8 p -86.42 115.26 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 CA-C-O 121.866 0.841 . . . . 64.41 109.622 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -124.64 96.77 5.02 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.851 -0.613 . . . . 74.24 109.85 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' MET . . . . . 0.46 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 62.0 mtt -77.75 133.97 38.16 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.477 -0.934 . . . . 73.35 108.477 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 58.5 t -78.12 101.57 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.314 0 N-CA-C 107.551 -1.277 . . . . 61.42 107.551 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 73.8 mt -93.35 156.67 16.65 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-N 115.495 -0.775 . . . . 45.11 110.309 -177.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -103.31 179.76 4.18 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 105.878 -1.897 . . . . 73.24 105.878 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -55.57 -38.72 69.73 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 124.054 0.941 . . . . 75.41 112.424 -174.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.93 -1.85 27.52 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.274 0.559 . . . . 74.14 111.941 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 78.69 31.95 42.99 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.783 -0.722 . . . . 45.12 111.898 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -118.01 139.78 27.02 Favored Pre-proline 0 C--N 1.307 -1.264 0 N-CA-C 107.577 -1.268 . . . . 74.05 107.577 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.47 134.17 49.96 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.051 1.834 . . . . 73.3 110.987 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.8 m -75.94 1.87 14.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.647 0.737 . . . . 65.22 110.929 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.71 -30.76 6.23 Favored Glycine 0 CA--C 1.49 -1.481 0 CA-C-N 115.452 -0.794 . . . . 73.31 112.145 175.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . 0.447 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.1 p-10 -113.45 149.9 33.56 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-O 121.184 0.516 . . . . 55.12 111.639 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . 0.46 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -150.75 155.56 39.52 Favored 'General case' 0 C--O 1.204 -1.31 0 CA-C-N 115.497 -0.774 . . . . 55.3 109.533 -177.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . 0.539 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 81.5 m-85 -111.28 146.09 37.62 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-O 121.189 0.519 . . . . 65.15 111.42 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 61.1 mt -126.51 122.13 60.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 106.52 -1.659 . . . . 75.43 106.52 172.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -100.96 114.08 27.65 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 115.633 -0.712 . . . . 73.05 109.907 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 94.9 mmm -92.88 172.94 8.01 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.4 0.619 . . . . 64.14 111.419 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -75.51 -40.47 57.03 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.045 -0.979 . . . . 74.1 110.192 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 41.5 t -140.98 150.81 43.56 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 116.268 -0.423 . . . . 73.4 110.289 -175.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.56 -29.79 70.45 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 123.969 0.908 . . . . 73.41 112.324 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -64.08 -42.84 96.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.868 0.842 . . . . 74.43 109.693 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -68.53 -38.73 81.09 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 114.534 -1.212 . . . . 74.14 110.463 177.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.35 90.81 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.891 -0.595 . . . . 53.02 110.975 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -68.78 -42.26 77.67 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.848 -0.427 . . . . 74.14 109.848 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 51.1 ttm -64.26 -40.91 96.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.987 -0.551 . . . . 74.41 110.486 -177.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.37 -39.95 81.61 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 116.226 -0.443 . . . . 54.13 110.188 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.89 -37.22 81.5 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 116.17 -0.468 . . . . 65.01 111.123 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -65.32 -44.58 87.39 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.944 -0.391 . . . . 54.54 109.944 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -66.09 -39.95 90.4 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.87 -0.605 . . . . 74.32 110.583 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 38.2 m -99.43 12.38 36.53 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 113.259 0.837 . . . . 74.32 113.259 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -70.23 95.69 1.03 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.365 -0.834 . . . . 63.31 109.891 176.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.1 tttt 64.33 62.65 0.81 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.977 1.711 . . . . 75.41 110.056 -177.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -108.14 148.56 29.68 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 112.641 -2.072 . . . . 73.42 108.803 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -77.12 119.87 21.42 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.176 0.512 . . . . 75.13 110.221 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.6 ttt -103.98 80.32 1.73 Allowed 'General case' 0 N--CA 1.404 -2.729 0 N-CA-C 105.584 -2.006 . . . . 61.23 105.584 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . 0.496 ' HD2' ' N ' ' A' ' 514' ' ' LYS . 0.1 OUTLIER 68.8 -75.75 0.06 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 113.601 -1.636 . . . . 72.34 112.204 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -106.09 -31.79 8.55 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 113.292 0.849 . . . . 54.55 113.292 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -110.61 157.79 19.3 Favored 'General case' 0 C--N 1.273 -2.719 0 CA-C-N 115.788 -0.642 . . . . 74.31 110.542 -168.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -95.32 126.89 40.94 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.467 -1.679 . . . . 54.51 106.467 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . 0.426 HG21 ' O ' ' A' ' 451' ' ' GLY . 66.7 t -114.06 120.28 63.42 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.678 0 N-CA-C 108.795 -0.817 . . . . 73.42 108.795 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.83 112.47 22.51 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 107.785 -1.191 . . . . 75.2 107.785 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -103.69 129.68 55.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 109.963 -0.384 . . . . 53.32 109.963 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.662 -0.699 . . . . 74.22 109.244 -177.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . 0.453 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 42.0 tt0 -87.63 155.64 19.85 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.038 -1.097 . . . . 63.35 108.038 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . 0.453 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 7.9 p -162.05 171.69 17.12 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.461 0.648 . . . . 74.11 110.942 -178.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 60.3 p -91.88 155.35 18.25 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.104 -0.953 . . . . 72.44 110.167 177.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.67 -27.82 52.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.316 -0.856 . . . . 72.2 111.433 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.32 -51.87 67.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 74.32 109.168 176.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.7 -37.42 87.27 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.338 -0.846 . . . . 74.23 109.883 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' MET . . . . . 0.449 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 24.8 ttt -61.56 -46.85 88.14 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.695 -0.684 . . . . 74.21 110.848 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -73.4 -28.97 62.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.925 -0.71 . . . . 73.32 109.639 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.33 -47.86 82.36 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 115.739 -0.664 . . . . 73.34 110.231 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.7 t -69.76 -34.54 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 120.826 -0.35 . . . . 75.14 110.276 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.3 mt . . . . . 0 C--N 1.327 -0.392 0 CA-C-O 120.903 0.382 . . . . 71.13 111.094 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 C--O 1.245 0.819 0 N-CA-C 109.465 -0.569 . . . . 74.05 109.465 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.502 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 54.4 mtm180 -80.87 63.78 5.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.805 0.812 . . . . 74.34 109.758 176.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 40.7 p-10 -95.79 4.21 53.08 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 115.31 -0.859 . . . . 64.04 110.012 -175.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.589 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 39.3 m -102.7 149.43 24.45 Favored 'General case' 0 N--CA 1.411 -2.419 0 CA-C-O 121.616 0.722 . . . . 75.21 110.618 -174.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . 0.632 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.4 mt -125.46 145.4 32.89 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.738 0 CA-C-N 114.608 -1.178 . . . . 54.53 107.95 178.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -119.83 120.37 36.27 Favored 'General case' 0 N--CA 1.416 -2.161 0 N-CA-C 106.472 -1.677 . . . . 75.2 106.472 172.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 13.0 mt -103.93 131.5 51.1 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 106.741 -1.578 . . . . 75.24 106.741 -178.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -132.82 142.98 49.25 Favored 'General case' 0 C--N 1.257 -3.415 0 N-CA-C 108.497 -0.927 . . . . 71.12 108.497 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 96.4 26.24 11.27 Favored Glycine 0 C--N 1.289 -2.03 0 C-N-CA 120.052 -1.07 . . . . 63.34 110.765 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 64.3 mt -72.95 144.25 85.07 Favored Pre-proline 0 C--N 1.304 -1.376 0 N-CA-C 109.276 -0.638 . . . . 71.24 109.276 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -55.41 161.13 7.75 Favored 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.883 2.389 . . . . 70.51 112.001 175.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -77.35 90.63 3.79 Favored 'General case' 0 N--CA 1.411 -2.417 0 CA-C-N 115.067 -0.97 . . . . 72.04 111.04 -177.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.11 29.93 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 112.085 -2.325 . . . . 74.14 112.672 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.15 140.79 52.66 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.3 -1.37 . . . . 74.5 107.3 170.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 68.2 p -86.43 174.39 9.02 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 120.345 -0.542 . . . . 72.03 111.709 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.42 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 72.0 mt -63.97 -37.37 79.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 108.998 -0.742 . . . . 74.04 108.998 177.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.15 -37.6 87.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.86 -0.609 . . . . 73.21 109.811 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -65.75 -42.85 90.43 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.806 -0.634 . . . . 65.11 110.706 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.4 HG21 ' O ' ' A' ' 458' ' ' ILE . 9.3 tp -72.71 -33.39 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 119.98 -0.688 . . . . 71.2 110.681 -177.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -68.88 -32.86 72.83 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.156 0.503 . . . . 63.13 109.668 177.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.77 -52.71 59.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-N 115.127 -0.942 . . . . 51.55 108.766 176.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.26 -41.29 79.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.078 -1.419 . . . . 70.22 111.325 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 67.9 mt -67.78 -32.6 73.29 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.892 -0.594 . . . . 73.2 111.859 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.06 -124.09 7.61 Favored Glycine 0 N--CA 1.418 -2.537 0 C-N-CA 119.377 -1.392 . . . . 63.44 113.129 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -42.58 -42.21 3.31 Favored 'General case' 0 C--N 1.287 -2.146 0 C-N-CA 126.693 1.997 . . . . 72.53 112.625 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -66.16 -12.37 55.43 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.359 -0.837 . . . . 71.53 112.785 -172.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.35 -15.7 60.93 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.406 0.622 . . . . 71.12 110.352 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.5 m -85.23 -28.03 25.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.63 0.729 . . . . 53.23 110.238 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -106.75 15.68 25.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.906 0.86 . . . . 74.02 110.631 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -68.43 142.6 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 N-CA-C 108.856 -0.794 . . . . 71.31 108.856 176.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.15 143.36 33.93 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 106.142 -1.799 . . . . 70.32 106.142 178.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 22.3 m -54.8 106.86 0.24 Allowed 'General case' 0 C--N 1.298 -1.635 0 O-C-N 124.254 0.971 . . . . 75.11 111.944 -172.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 27.0 m170 60.72 35.03 19.79 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.026 0.93 . . . . 73.4 111.729 -177.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -83.41 -0.39 90.02 Favored Glycine 0 N--CA 1.432 -1.625 0 CA-C-N 115.004 -0.998 . . . . 65.12 111.422 175.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 5.5 p -82.06 127.86 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 CA-C-O 121.221 0.534 . . . . 73.4 110.05 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -138.77 96.83 3.2 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.054 -1.091 . . . . 73.14 108.054 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' MET . . . . . 0.493 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 55.4 ttm -78.24 139.75 38.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.366 -0.605 . . . . 74.5 109.366 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 74.7 t -94.29 110.61 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.726 0 CA-C-O 122.105 0.955 . . . . 73.21 111.136 -176.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -104.59 159.8 15.46 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.189 -1.368 . . . . 73.34 108.142 175.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -114.04 -168.97 1.43 Allowed 'General case' 0 C--N 1.273 -2.742 0 N-CA-C 108.435 -0.95 . . . . 72.35 108.435 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 31.9 t60 -54.14 -28.71 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 124.006 0.922 . . . . 63.54 111.97 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -75.01 -12.69 60.39 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.01 0.433 . . . . 73.42 110.888 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 79.76 25.18 58.83 Favored Glycine 0 N--CA 1.433 -1.554 0 N-CA-C 112.122 -0.391 . . . . 64.31 112.122 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -130.66 149.87 74.79 Favored Pre-proline 0 C--N 1.308 -1.207 0 N-CA-C 107.129 -1.434 . . . . 71.02 107.129 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . 0.493 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 12.3 Cg_endo -57.35 130.48 39.46 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.379 2.053 . . . . 73.41 111.576 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 16.3 m -81.35 9.07 7.73 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.299 -0.864 . . . . 74.52 111.033 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 80.6 23.33 60.45 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 109.871 -1.292 . . . . 61.45 109.871 -176.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -142.13 141.25 32.66 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.508 -1.293 . . . . 70.45 107.508 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.51 160.29 28.96 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 122.556 0.342 . . . . 53.51 110.31 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . 0.425 ' HB3' ' HE2' ' A' ' 528' ' ' MET . 70.2 m-85 -118.97 144.41 46.5 Favored 'General case' 0 C--N 1.291 -1.974 0 N-CA-C 109.189 -0.671 . . . . 75.31 109.189 175.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.5 131.52 44.24 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 107.577 -1.268 . . . . 74.32 107.577 174.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . 0.589 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 33.6 tt0 -104.98 131.94 51.87 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 108.165 -1.05 . . . . 70.51 108.165 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' MET . . . . . 0.632 ' SD ' HD11 ' A' ' 447' ' ' ILE . 67.9 mtp -104.43 178.07 4.67 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 123.008 0.523 . . . . 73.34 110.241 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -74.3 -36.05 63.72 Favored 'General case' 0 N--CA 1.407 -2.592 0 C-N-CA 123.329 0.652 . . . . 74.35 111.841 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 69.3 m -144.64 153.66 41.99 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 113.085 0.772 . . . . 71.04 113.085 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.05 68.77 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.523 1.129 . . . . 74.41 111.98 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.56 -49.3 77.93 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 115.783 -0.644 . . . . 72.21 111.62 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.85 -28.7 55.58 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.298 -0.561 . . . . 65.34 111.552 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.67 -43.57 96.31 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.512 0.507 . . . . 73.1 109.858 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -69.3 -38.86 78.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.314 0.578 . . . . 75.03 109.457 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.92 -44.01 97.78 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.285 -0.87 . . . . 42.43 109.622 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.8 97.97 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.877 -0.601 . . . . 45.33 110.6 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . 0.442 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -71.58 -22.94 61.66 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 112.079 0.4 . . . . 73.31 112.079 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -85.72 -42.17 14.48 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.602 -0.518 . . . . 64.33 109.602 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -70.48 -38.47 74.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.84 -0.618 . . . . 70.04 109.997 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 56.6 m -107.84 23.8 13.91 Favored 'General case' 0 N--CA 1.421 -1.885 0 CA-C-N 115.831 -0.622 . . . . 73.41 110.92 -177.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 29.3 t-80 -64.93 97.25 0.22 Allowed 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.606 -0.887 . . . . 71.21 108.606 172.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 97.9 mttt 59.32 62.55 1.77 Allowed 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.362 1.065 . . . . 71.32 110.341 -179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -103.71 134.04 47.69 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 114.919 -1.037 . . . . 71.43 109.049 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -73.32 133.33 43.83 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 116.013 -0.54 . . . . 72.31 110.919 -176.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.8 ttt -126.37 104.31 8.11 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 107.95 -1.13 . . . . 70.01 107.95 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.29 -72.66 0.1 Allowed 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 124.825 1.25 . . . . 75.45 110.782 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -141.16 -13.12 0.92 Allowed 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 112.754 0.65 . . . . 54.02 112.754 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 517' ' ' TYR . 0.0 OUTLIER -124.92 149.72 47.3 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 108.246 -1.02 . . . . 73.41 108.246 -174.388 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . 0.403 ' N ' ' HD3' ' A' ' 516' ' ' ARG . 55.7 m-85 -88.25 128.56 35.47 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 112.714 0.635 . . . . 73.12 112.714 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 91.2 t -96.2 112.39 28.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.128 -1.396 . . . . 72.23 107.343 176.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -97.59 114.78 26.77 Favored 'General case' 0 C--N 1.269 -2.892 0 N-CA-C 106.973 -1.492 . . . . 74.51 106.973 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 78.4 t -104.08 123.71 58.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.883 -0.599 . . . . 73.31 109.884 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -121.63 147.92 45.23 Favored 'General case' 0 C--O 1.208 -1.116 0 C-N-CA 124.003 0.921 . . . . 74.03 108.842 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -95.66 152.43 18.46 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.226 0.466 . . . . 73.02 110.939 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.4 m -152.15 170.71 19.31 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 123.128 0.571 . . . . 73.51 110.592 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 35.1 t -105.38 156.78 17.85 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 116.212 -0.449 . . . . 63.14 109.976 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . 0.475 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -57.73 -42.89 84.77 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.217 0.451 . . . . 72.13 112.217 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.09 -31.49 70.26 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.68 0.753 . . . . 72.44 109.46 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -72.61 -37.26 68.15 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.999 -1.0 . . . . 51.42 110.678 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' MET . . . . . 0.515 ' HE1' ' SG ' ' A' ' 446' ' ' CYS . 42.8 ttm -61.44 -44.88 96.33 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.655 -0.868 . . . . 62.4 108.655 175.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -62.41 -38.08 88.29 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.797 -1.092 . . . . 72.42 110.21 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -58.3 -47.89 82.24 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.691 0.796 . . . . 54.42 109.925 177.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.79 -34.42 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.174 0.511 . . . . 54.43 110.302 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 85.0 mt . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 116.355 -0.384 . . . . 64.35 111.722 179.089 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 39.0 t . . . . . 0 C--O 1.252 1.211 0 CA-C-O 121.985 0.898 . . . . 71.42 111.927 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.528 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 98.6 mtt180 -89.5 70.26 7.96 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.099 -0.955 . . . . 74.03 109.991 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -123.22 18.7 9.9 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.256 -1.338 . . . . 72.14 110.497 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 63.6 m -113.43 156.82 22.81 Favored 'General case' 0 N--CA 1.417 -2.116 0 C-N-CA 119.682 -0.807 . . . . 75.5 109.424 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -129.18 139.11 52.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 N-CA-C 108.508 -0.923 . . . . 75.31 108.508 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 -108.2 120.93 43.77 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 107.045 -1.465 . . . . 73.11 107.045 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . 0.451 ' HA ' ' O ' ' A' ' 519' ' ' GLU . 12.3 mt -100.11 145.54 27.85 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.848 -1.538 . . . . 70.24 106.848 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -141.15 137.06 32.45 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 109.998 -0.371 . . . . 73.43 109.998 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 94.41 34.45 6.36 Favored Glycine 0 C--N 1.298 -1.548 0 CA-C-N 115.964 -0.562 . . . . 75.12 113.047 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 88.1 mt -75.3 150.31 85.03 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 116.881 0.341 . . . . 43.55 111.159 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.7 156.24 58.61 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 C-N-CA 122.868 2.379 . . . . 61.41 112.207 176.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -75.31 93.63 2.91 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.029 -1.442 . . . . 75.14 109.731 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 85.07 38.71 0.02 OUTLIER 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 111.841 -2.436 . . . . 75.14 111.388 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.24 137.49 57.04 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.205 -1.035 . . . . 74.2 108.205 169.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 15.4 p -81.5 156.93 25.03 Favored 'General case' 0 N--CA 1.416 -2.156 0 CA-C-N 116.66 -0.246 . . . . 65.21 110.535 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.454 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 63.3 mt -63.17 -32.52 56.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.746 0.784 . . . . 72.05 109.202 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -67.27 -36.14 80.97 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.486 -0.779 . . . . 71.21 110.216 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . 0.448 ' CG ' ' HZ2' ' A' ' 514' ' ' LYS . 22.8 t70 -74.08 -35.83 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.185 -0.462 . . . . 63.24 110.372 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.421 HG21 ' O ' ' A' ' 458' ' ' ILE . 12.5 tt -73.35 -33.47 40.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 120.443 -0.503 . . . . 71.22 110.286 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.3 mt -67.71 -35.46 78.83 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.409 0.623 . . . . 72.32 109.526 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.28 -49.85 74.03 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-N 115.213 -0.903 . . . . 72.3 109.45 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -51.88 -44.97 63.95 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.025 -1.443 . . . . 74.2 111.002 177.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.9 -36.56 83.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.388 -0.823 . . . . 73.23 111.648 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 72.87 -132.17 16.9 Favored Glycine 0 CA--C 1.476 -2.367 0 C-N-CA 120.396 -0.907 . . . . 74.43 111.246 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -52.32 -36.37 53.11 Favored 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 124.973 1.309 . . . . 72.44 109.795 176.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -70.33 -5.8 30.57 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.101 -0.954 . . . . 73.22 112.756 -176.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -72.85 -15.51 61.61 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.421 0.629 . . . . 74.42 109.769 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 28.5 m -91.06 -16.91 27.1 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 121.748 0.785 . . . . 55.31 109.263 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . 0.483 ' O ' ' HG3' ' A' ' 495' ' ' MET . 69.2 m-20 -98.26 0.15 45.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.84 -0.618 . . . . 75.15 112.549 -174.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 14.2 tt -79.06 158.39 4.7 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 N-CA-C 108.378 -0.971 . . . . 74.24 108.378 176.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -87.93 157.57 18.91 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.785 -1.191 . . . . 73.33 107.785 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.2 m -52.19 107.13 0.18 Allowed 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 124.028 0.931 . . . . 74.13 112.298 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 49.3 m80 61.94 29.08 17.7 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.298 1.039 . . . . 70.44 111.408 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 493' ' ' ILE . . . -78.06 -3.11 84.41 Favored Glycine 0 N--CA 1.439 -1.159 0 CA-C-N 115.63 -0.714 . . . . 73.03 112.774 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 5.0 p -83.07 103.24 10.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.17 0 CA-C-O 121.507 0.67 . . . . 74.31 110.686 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -114.99 91.75 3.72 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 116.246 -0.434 . . . . 72.24 110.116 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' MET . . . . . 0.404 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 69.8 mtm -77.54 129.07 35.19 Favored 'General case' 0 CA--C 1.489 -1.392 0 N-CA-C 106.23 -1.767 . . . . 62.44 106.23 173.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.0 t -81.13 118.39 28.82 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-O 121.47 0.653 . . . . 72.0 110.523 -173.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 69.8 mt -96.59 152.84 18.25 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.451 -1.314 . . . . 72.04 107.451 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -92.59 -170.44 2.47 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 107.883 -1.154 . . . . 71.14 107.883 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -72.15 -5.2 33.84 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 124.022 0.929 . . . . 71.01 113.275 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -109.87 12.07 24.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-O 121.505 0.669 . . . . 53.44 109.525 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 68.05 31.78 75.69 Favored Glycine 0 CA--C 1.505 -0.558 0 CA-C-N 115.604 -0.725 . . . . 72.11 112.88 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -121.45 142.21 35.02 Favored Pre-proline 0 C--N 1.305 -1.342 0 N-CA-C 107.0 -1.482 . . . . 74.12 107.0 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -52.42 129.86 33.63 Favored 'Trans proline' 0 N--CA 1.477 0.53 0 C-N-CA 123.161 2.574 . . . . 72.42 113.373 -177.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.7 m -77.39 -20.76 54.2 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.859 -0.609 . . . . 74.12 110.118 178.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 114.58 -18.6 17.32 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.66 -0.7 . . . . 75.5 111.699 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -112.78 164.45 13.37 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 120.929 0.395 . . . . 62.11 110.244 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . 0.404 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -155.17 160.28 40.78 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.628 -0.714 . . . . 53.54 109.083 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.52 120.27 25.09 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.518 -1.289 . . . . 74.43 107.518 174.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' A' ' 476' ' ' GLY . 1.7 mp -111.9 132.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.256 0 N-CA-C 108.393 -0.966 . . . . 70.02 108.393 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -103.45 121.98 43.94 Favored 'General case' 0 C--N 1.258 -3.392 0 N-CA-C 108.022 -1.103 . . . . 71.33 108.022 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 471' ' ' ASP . 2.0 tpt -92.9 171.45 8.96 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.533 -0.758 . . . . 50.33 109.987 -173.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -74.57 -36.59 63.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.007 0.923 . . . . 75.2 109.941 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.2 m -146.51 152.11 38.46 Favored 'General case' 0 N--CA 1.423 -1.819 0 CA-C-N 115.799 -0.637 . . . . 43.42 109.797 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.62 -36.49 78.73 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.108 0.88 . . . . 72.2 111.765 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -61.08 -48.82 79.95 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 115.504 -0.771 . . . . 75.43 110.388 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -68.87 -31.08 69.77 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.556 -1.202 . . . . 74.0 112.294 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.27 -48.29 70.9 Favored 'General case' 0 C--N 1.309 -1.175 0 O-C-N 123.392 0.433 . . . . 73.15 110.041 175.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -66.88 -38.98 87.32 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 116.053 -0.522 . . . . 74.24 110.312 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 47.5 tpp -65.81 -41.28 92.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.99 -0.55 . . . . 65.35 110.532 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.08 77.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 120.902 0.382 . . . . 71.42 110.401 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -71.36 -36.98 71.66 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.864 -0.607 . . . . 73.41 111.799 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -46.29 68.1 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 107.588 -1.264 . . . . 73.3 107.588 177.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -62.86 -33.5 75.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.894 -1.048 . . . . 63.44 110.53 -177.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . 0.462 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 61.9 m -116.05 19.66 14.86 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 114.83 1.419 . . . . 75.04 114.83 -176.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . 0.433 ' CD2' ' HD3' ' A' ' 510' ' ' LYS . 12.8 t60 -68.18 108.77 3.27 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 107.809 -1.182 . . . . 73.43 107.809 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.433 ' HD3' ' CD2' ' A' ' 509' ' ' HIS . 14.1 mptt 63.73 52.7 2.14 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 122.173 0.987 . . . . 53.21 110.45 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . 0.462 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 21.9 tptm -89.11 139.63 30.27 Favored 'General case' 0 N--CA 1.412 -2.344 0 CA-C-N 114.539 -1.21 . . . . 74.25 109.194 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -76.9 121.93 24.12 Favored 'General case' 0 C--N 1.284 -2.248 0 N-CA-C 108.188 -1.042 . . . . 72.32 108.188 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.444 ' HE2' ' OD2' ' A' ' 460' ' ' ASP . 25.6 ttt -105.84 77.31 1.24 Allowed 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.428 -2.064 . . . . 63.54 105.428 177.043 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . 0.448 ' HZ2' ' CG ' ' A' ' 460' ' ' ASP . 2.7 mppt? 69.75 -81.94 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.812 -1.54 . . . . 65.51 110.022 -172.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -125.67 -4.88 7.05 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-O 122.135 0.969 . . . . 65.24 110.872 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -94.22 160.12 14.83 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.016 -1.476 . . . . 71.23 107.016 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -120.35 118.27 29.94 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.722 -1.584 . . . . 70.23 106.722 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 96.0 t -112.79 134.6 54.88 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.996 0 CA-C-O 121.539 0.685 . . . . 72.13 111.458 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 449' ' ' LEU . 32.0 tt0 -95.5 114.31 26.06 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.399 -0.963 . . . . 74.12 108.399 176.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . 0.421 HG22 HD21 ' A' ' 449' ' ' LEU . 57.3 t -109.39 112.84 42.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 N-CA-C 107.729 -1.211 . . . . 60.32 107.729 176.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -128.31 123.39 33.9 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.218 -0.301 . . . . 70.54 111.751 -174.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . 0.401 ' OE1' ' HB3' ' A' ' 444' ' ' ARG . 0.6 OUTLIER -70.99 136.0 48.16 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.883 0.373 . . . . 72.2 110.928 -178.784 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 61.4 m -145.01 170.37 16.29 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 124.39 1.076 . . . . 75.24 109.307 -177.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.528 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 40.4 t -82.88 154.15 24.76 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.32 -0.622 . . . . 74.3 109.32 175.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -65.24 -23.57 67.1 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.433 -0.803 . . . . 63.11 109.489 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.98 -45.3 93.08 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.226 -0.657 . . . . 72.03 109.226 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -64.32 -40.63 96.29 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.075 0.464 . . . . 75.42 109.874 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' MET . . . . . 0.475 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.9 ttt -60.07 -47.64 85.05 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.361 -0.836 . . . . 63.42 110.382 178.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.15 -37.92 84.61 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 115.322 -0.854 . . . . 60.51 110.072 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -63.02 -43.0 99.93 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.255 -0.884 . . . . 75.44 110.01 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.83 -37.15 72.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 120.776 -0.369 . . . . 71.55 110.442 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.1 mt . . . . . 0 N--CA 1.467 0.42 0 CA-C-O 120.913 0.387 . . . . 63.24 111.804 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.424 -1.754 0 N-CA-C 107.199 -1.408 . . . . 63.24 107.199 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.513 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 95.5 mtt180 -94.01 75.42 4.13 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 122.313 1.054 . . . . 73.33 108.32 174.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.1 p30 -122.3 10.62 9.95 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 113.39 -1.732 . . . . 74.12 111.456 -172.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . 0.55 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 29.3 m -104.61 141.36 36.57 Favored 'General case' 0 N--CA 1.4 -2.947 0 N-CA-C 108.417 -0.957 . . . . 62.43 108.417 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -123.73 139.11 51.24 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.415 0 N-CA-C 107.766 -1.198 . . . . 72.31 107.766 -177.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . 0.458 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.4 ttp180 -114.38 123.95 50.74 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 108.948 -0.76 . . . . 71.44 108.948 175.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . 0.43 ' CD1' HD11 ' A' ' 461' ' ' ILE . 5.6 mt -102.11 138.1 39.5 Favored 'General case' 0 C--N 1.285 -2.235 0 N-CA-C 106.387 -1.709 . . . . 73.22 106.387 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 63.0 ttp180 -132.38 125.06 29.94 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-O 121.168 0.508 . . . . 62.21 110.15 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.42 45.69 1.41 Allowed Glycine 0 C--N 1.272 -2.985 0 CA-C-N 115.1 -0.954 . . . . 75.25 111.111 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 92.9 mt -84.19 140.26 39.49 Favored Pre-proline 0 N--CA 1.433 -1.309 0 O-C-N 122.86 -0.2 . . . . 74.04 110.547 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.55 150.75 33.71 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 123.208 2.606 . . . . 73.35 112.713 176.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -72.97 103.4 3.75 Favored 'General case' 0 N--CA 1.396 -3.169 0 N-CA-C 107.304 -1.369 . . . . 72.2 107.304 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 91.94 33.37 0.01 OUTLIER 'General case' 0 C--N 1.279 -2.469 0 CA-C-N 111.254 -2.703 . . . . 65.45 112.446 175.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -71.44 109.17 5.25 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 107.17 -1.419 . . . . 73.2 107.17 168.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.7 p -75.23 167.79 21.24 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.71 0.291 . . . . 72.33 110.791 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 59.7 mt -63.85 -32.49 57.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.983 0.421 . . . . 74.44 110.392 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.84 -49.75 69.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.306 0.574 . . . . 73.22 109.563 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . 0.415 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 34.1 t70 -67.32 -32.14 72.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.277 -0.874 . . . . 75.32 111.324 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.484 HG23 ' O ' ' A' ' 458' ' ' ILE . 11.2 tt -75.94 -30.37 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 109.959 -0.385 . . . . 75.21 109.959 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.6 mt -68.53 -35.03 76.9 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.25 -0.648 . . . . 73.44 109.25 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . 0.415 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 24.0 t70 -60.04 -51.68 68.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.21 -0.905 . . . . 72.22 109.242 173.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -55.16 -40.21 70.39 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.204 -1.362 . . . . 74.42 111.912 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.54 -31.96 73.3 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.982 -0.554 . . . . 75.32 111.911 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.83 -128.94 15.36 Favored Glycine 0 CA--C 1.474 -2.491 0 C-N-CA 120.447 -0.882 . . . . 54.54 111.922 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -58.93 -28.37 66.18 Favored 'General case' 0 C--N 1.273 -2.735 0 CA-C-N 113.802 -1.199 . . . . 72.12 111.698 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -75.74 -5.88 47.88 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 112.454 0.539 . . . . 74.23 112.454 -178.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.54 63.56 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.309 0.576 . . . . 60.53 111.422 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 16.4 m -97.85 -6.32 32.77 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 121.371 0.605 . . . . 64.12 109.971 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . 0.447 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 70.6 m-20 -99.22 -5.73 29.4 Favored 'General case' 0 C--O 1.242 0.69 0 O-C-N 121.94 -0.475 . . . . 61.13 112.2 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . 0.477 ' HA ' ' SD ' ' A' ' 495' ' ' MET . 13.0 tt -69.02 148.48 11.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 CA-C-N 115.273 -0.876 . . . . 71.53 109.897 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -72.28 173.39 8.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.132 -0.627 . . . . 73.11 110.499 176.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.9 m -62.05 102.83 0.31 Allowed 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.302 -0.863 . . . . 73.32 108.973 176.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 58.05 52.8 7.31 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.939 1.295 . . . . 74.0 108.281 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -73.72 -16.42 79.2 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.904 -1.044 . . . . 74.44 113.439 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.51 121.39 36.66 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-O 121.701 0.762 . . . . 74.32 111.45 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -132.95 106.84 7.92 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 107.515 -1.291 . . . . 73.35 107.515 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.9 mtt -88.12 139.57 30.37 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 120.214 -0.595 . . . . 74.43 110.306 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 61.8 t -83.54 107.19 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.481 -0.933 . . . . 62.41 108.481 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.7 mt -88.65 154.67 20.12 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 114.436 -1.256 . . . . 75.43 109.748 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -92.81 160.84 14.76 Favored 'General case' 0 C--N 1.284 -2.261 0 N-CA-C 104.72 -2.326 . . . . 73.42 104.72 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -64.51 -14.17 56.02 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 119.2 0.909 . . . . 75.54 112.031 -178.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -71.31 -16.72 62.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.414 0.685 . . . . 73.41 109.99 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.52 33.44 22.3 Favored Glycine 0 N--CA 1.435 -1.397 0 CA-C-O 121.941 0.745 . . . . 61.22 111.285 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -128.61 150.83 75.77 Favored Pre-proline 0 C--N 1.29 -1.98 0 N-CA-C 106.127 -1.805 . . . . 63.53 106.127 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.39 126.58 18.78 Favored 'Trans proline' 0 C--O 1.247 0.968 0 C-N-CA 121.587 1.524 . . . . 71.14 111.39 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 20.0 m -67.92 -24.86 65.24 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.605 0.716 . . . . 63.13 110.198 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 125.86 -20.15 6.44 Favored Glycine 0 N--CA 1.429 -1.784 0 N-CA-C 110.91 -0.876 . . . . 52.42 110.91 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -111.14 154.44 24.32 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.881 0.372 . . . . 61.11 110.752 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.59 40.81 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.286 -0.635 . . . . 63.35 109.286 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . 0.458 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 85.4 m-85 -118.36 137.48 53.08 Favored 'General case' 0 C--N 1.293 -1.871 0 N-CA-C 109.315 -0.624 . . . . 75.43 109.315 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 52.5 mt -125.3 124.95 68.27 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.202 0 N-CA-C 107.22 -1.4 . . . . 64.31 107.22 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -102.86 122.93 45.53 Favored 'General case' 0 C--N 1.27 -2.885 0 CA-C-N 115.683 -0.69 . . . . 71.14 110.247 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 472' ' ' ILE . 26.2 mmt -96.45 169.29 10.01 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 123.691 0.796 . . . . 75.42 111.608 -176.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -65.32 -32.47 74.14 Favored 'General case' 0 N--CA 1.421 -1.919 0 CA-C-N 115.492 -0.777 . . . . 64.32 112.737 178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 38.8 p -152.5 163.94 38.57 Favored 'General case' 0 C--O 1.25 1.106 0 CA-C-O 120.587 0.232 . . . . 73.52 111.389 -177.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.24 85.14 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 123.723 0.809 . . . . 63.41 111.443 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -54.45 -50.57 67.37 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.406 -0.816 . . . . 73.11 111.832 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . 0.447 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 2.4 mmp_? -64.53 -42.2 95.91 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 113.846 -1.524 . . . . 75.14 109.77 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.04 91.17 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.038 -0.983 . . . . 70.04 110.683 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -64.57 -41.62 96.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.816 -0.629 . . . . 55.14 110.893 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.0 mtp -74.09 -34.61 64.03 Favored 'General case' 0 CA--C 1.508 -0.64 0 C-N-CA 119.625 -0.83 . . . . 63.43 110.85 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.87 -40.4 79.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 116.25 -0.432 . . . . 71.33 110.09 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.7 -38.72 84.04 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 116.112 -0.494 . . . . 73.55 111.195 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -67.8 -42.38 81.66 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.497 -0.32 . . . . 74.11 110.927 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.4 -41.8 75.96 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 120.595 -0.442 . . . . 75.33 110.819 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 47.9 m -95.93 11.39 34.05 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 113.241 0.83 . . . . 65.31 113.241 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -66.17 97.6 0.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 O-C-N 121.324 -0.86 . . . . 74.42 110.861 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm 75.22 33.12 0.72 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.301 1.44 . . . . 71.22 109.484 175.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -80.59 150.4 29.53 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.462 -1.245 . . . . 73.14 109.817 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.15 143.56 33.77 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 120.69 0.281 . . . . 75.35 110.528 177.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.4 ttt -140.37 103.67 4.62 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.927 -1.138 . . . . 74.41 107.927 175.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp 66.81 -84.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 125.008 1.323 . . . . 63.42 111.013 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.31 -0.52 2.98 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.919 -0.771 . . . . 65.05 108.919 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -113.7 160.48 18.59 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.127 -1.064 . . . . 74.12 108.127 -172.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -113.45 118.85 35.65 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.659 -0.867 . . . . 74.23 108.659 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.85 112.66 35.73 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 CA-C-O 121.537 0.684 . . . . 64.12 109.558 -176.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -94.49 112.32 24.09 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 107.724 -1.213 . . . . 74.12 107.724 178.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.7 t -104.53 127.91 58.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 CA-C-O 121.111 0.481 . . . . 71.41 111.938 -176.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.78 148.36 48.18 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.502 -0.772 . . . . 75.53 109.365 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.55 142.06 32.54 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 122.41 0.284 . . . . 65.22 110.453 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.7 p -147.61 173.68 12.48 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.456 0.646 . . . . 75.15 111.839 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 80.3 p -85.02 158.99 20.31 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.217 -0.901 . . . . 74.4 110.584 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . 0.55 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -64.67 -29.04 70.04 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.968 -0.56 . . . . 65.32 110.038 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -73.93 -35.77 64.62 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 116.047 -0.524 . . . . 74.42 110.313 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -64.42 -47.14 80.27 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.379 -0.971 . . . . 73.12 108.379 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 23.5 ttt -60.45 -42.98 97.27 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.511 -1.222 . . . . 62.13 109.969 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -60.72 -45.51 93.99 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.017 -0.992 . . . . 74.43 109.63 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.59 -40.86 98.03 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.865 0.364 . . . . 74.1 111.076 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.25 -39.8 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.339 0.59 . . . . 72.4 110.751 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.317 -0.827 0 N-CA-C 112.649 0.611 . . . . 72.45 112.649 -176.76 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 23.3 t . . . . . 0 C--O 1.254 1.318 0 CA-C-O 121.19 0.519 . . . . 74.41 110.584 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.545 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 69.0 ttt180 -83.88 68.23 9.89 Favored 'General case' 0 N--CA 1.41 -2.459 0 N-CA-C 108.806 -0.813 . . . . 74.24 108.806 174.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . 0.419 ' HA ' ' HA ' ' A' ' 498' ' ' ALA . 14.5 p30 -119.66 16.38 12.79 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.229 1.012 . . . . 71.11 111.064 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 39.4 m -112.25 162.52 15.4 Favored 'General case' 0 N--CA 1.414 -2.257 0 N-CA-C 108.376 -0.972 . . . . 74.31 108.376 -176.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -128.18 138.42 54.73 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 N-CA-C 107.254 -1.387 . . . . 64.51 107.254 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -111.16 120.16 41.37 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 107.291 -1.374 . . . . 73.42 107.291 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . 0.421 HD22 HG22 ' A' ' 520' ' ' VAL . 11.1 mt -97.56 139.16 33.88 Favored 'General case' 0 C--N 1.283 -2.314 0 N-CA-C 106.325 -1.731 . . . . 64.34 106.325 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -138.1 132.32 31.86 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 109.226 -0.657 . . . . 72.23 109.226 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 102.83 38.56 2.91 Favored Glycine 0 C--N 1.289 -2.073 0 N-CA-C 110.441 -1.064 . . . . 64.04 110.441 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.82 138.03 96.34 Favored Pre-proline 0 C--O 1.243 0.75 0 CA-C-N 115.434 -0.383 . . . . 70.21 111.761 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.11 171.93 6.92 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.339 2.693 . . . . 63.23 113.41 176.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -77.65 99.51 5.82 Favored 'General case' 0 N--CA 1.394 -3.25 0 CA-C-N 113.44 -1.709 . . . . 74.01 108.959 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 79.57 33.42 0.21 Allowed 'General case' 0 C--N 1.272 -2.778 0 CA-C-N 112.157 -2.292 . . . . 74.31 112.005 170.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.38 113.31 2.85 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.149 -1.056 . . . . 65.3 108.149 171.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.6 p -80.12 170.09 16.92 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 116.361 -0.381 . . . . 74.24 111.336 -175.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.479 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.5 pt -61.43 -34.45 61.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 N-CA-C 112.225 0.454 . . . . 73.43 112.225 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.12 -33.77 63.69 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 119.625 -0.83 . . . . 73.13 110.66 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.27 -37.71 74.94 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.038 0.447 . . . . 53.52 110.511 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.413 HG23 ' O ' ' A' ' 458' ' ' ILE . 14.0 tt -70.65 -37.57 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 116.251 -0.431 . . . . 65.33 110.22 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 94.5 mt -67.62 -35.24 78.56 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.151 0.5 . . . . 74.1 110.121 177.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -62.95 -47.79 81.68 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.716 -0.675 . . . . 74.32 109.25 177.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -56.67 -42.87 79.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.562 -1.199 . . . . 74.42 110.938 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.77 -29.26 70.49 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.71 -0.677 . . . . 73.14 111.415 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.65 -121.13 21.41 Favored Glycine 0 CA--C 1.475 -2.468 0 CA-C-O 122.044 0.802 . . . . 63.43 113.088 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -51.75 -41.07 61.31 Favored 'General case' 0 C--N 1.266 -3.058 0 CA-C-N 112.675 -1.762 . . . . 63.03 111.405 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -82.36 1.87 35.09 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.608 -0.723 . . . . 75.14 112.52 -172.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -75.54 -15.67 60.35 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-O 121.078 0.466 . . . . 74.25 111.215 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 22.8 m -92.04 -14.47 29.29 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.342 0.592 . . . . 73.21 110.327 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . 0.442 ' CB ' ' HG2' ' A' ' 500' ' ' ARG . 2.9 m-20 -100.27 3.21 43.35 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 116.102 -0.499 . . . . 73.34 112.295 -176.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . 0.405 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.6 tt -73.31 148.79 8.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 N-CA-C 108.26 -1.015 . . . . 63.33 108.26 176.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . 0.405 ' O ' HG12 ' A' ' 472' ' ' ILE . 71.8 mtp180 -79.21 156.99 27.92 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.95 -1.13 . . . . 71.3 107.95 174.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 2.0 p -61.15 110.82 1.49 Allowed 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 112.487 0.551 . . . . 71.33 112.487 -178.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 63.21 35.26 12.78 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.664 1.186 . . . . 74.12 108.899 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.85 -10.52 83.62 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 114.854 -1.066 . . . . 71.3 111.202 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.2 p -81.21 105.07 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-O 122.162 0.982 . . . . 55.3 110.654 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -113.11 98.85 7.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.05 -0.977 . . . . 74.21 109.809 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 67.8 mtm -82.15 130.99 35.23 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.995 -1.113 . . . . 61.54 107.995 177.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . 0.491 ' O ' ' HA ' ' A' ' 487' ' ' PRO . 52.3 t -82.98 122.14 36.99 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 107.378 -1.342 . . . . 64.22 107.378 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.9 mt -99.99 154.9 18.02 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.226 0.536 . . . . 54.03 110.948 -175.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -102.72 175.66 5.42 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 105.417 -2.068 . . . . 64.25 105.417 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -60.0 -24.91 64.84 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.389 0.541 . . . . 73.43 110.713 -178.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . 0.473 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 8.6 tt0 -68.29 -17.24 64.23 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 123.684 0.794 . . . . 73.31 111.095 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.24 28.9 35.18 Favored Glycine 0 N--CA 1.441 -1.002 0 CA-C-N 116.151 -0.477 . . . . 65.03 112.168 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . 0.473 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 96.3 mtt180 -131.98 153.63 81.44 Favored Pre-proline 0 C--N 1.302 -1.474 0 N-CA-C 107.734 -1.21 . . . . 73.24 107.734 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . 0.491 ' HA ' ' O ' ' A' ' 480' ' ' VAL . 11.5 Cg_endo -56.32 133.25 56.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.514 2.143 . . . . 64.42 111.509 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 22.5 m -64.87 -12.57 50.21 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 123.751 0.82 . . . . 73.42 111.334 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 123.73 -12.72 8.24 Favored Glycine 0 CA--C 1.48 -2.108 0 N-CA-C 110.685 -0.966 . . . . 71.23 110.685 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -124.74 156.21 38.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-O 121.104 0.478 . . . . 72.24 110.601 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.5 150.79 29.97 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.195 -0.911 . . . . 70.11 108.751 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -112.04 127.87 56.02 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 108.906 -0.776 . . . . 75.14 108.906 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.54 128.75 73.8 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 107.921 -1.14 . . . . 73.41 107.921 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -104.29 124.36 49.03 Favored 'General case' 0 C--N 1.276 -2.589 0 CA-C-N 115.99 -0.55 . . . . 74.32 110.834 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -93.88 170.65 9.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.495 -0.775 . . . . 74.01 111.171 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -69.48 -28.54 66.16 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.87 -1.059 . . . . 73.02 110.097 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.5 m -154.42 151.16 28.66 Favored 'General case' 0 C--O 1.253 1.261 0 N-CA-C 109.332 -0.618 . . . . 74.31 109.332 -175.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . 0.419 ' HA ' ' HA ' ' A' ' 445' ' ' ASP . . . -62.42 -25.71 68.1 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.119 0.968 . . . . 70.13 112.847 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -54.69 -51.65 64.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.811 0.815 . . . . 74.53 110.083 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . 0.442 ' HG2' ' CB ' ' A' ' 471' ' ' ASP . 10.1 mpt_? -65.88 -38.0 87.64 Favored 'General case' 0 CA--C 1.496 -1.127 0 CA-C-N 114.426 -1.261 . . . . 74.23 110.381 -176.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.44 88.91 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.45 -0.795 . . . . 54.22 110.84 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -68.66 -40.87 80.0 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.23 0.538 . . . . 61.42 110.177 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 66.6 mtt -70.31 -38.08 74.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.78 -0.646 . . . . 74.03 110.79 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.47 -41.98 83.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.305 -0.407 . . . . 64.21 110.37 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.41 -38.15 84.17 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 116.365 -0.38 . . . . 71.14 110.827 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -70.39 -39.51 74.47 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.747 -0.381 . . . . 73.21 111.1 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.57 -28.49 56.26 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.014 0.435 . . . . 74.42 111.128 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 39.7 m -114.99 18.56 16.31 Favored 'General case' 0 C--O 1.254 1.294 0 N-CA-C 113.13 0.789 . . . . 73.05 113.13 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -68.51 106.6 2.61 Favored 'General case' 0 C--O 1.243 0.715 0 O-C-N 121.052 -1.03 . . . . 73.22 109.868 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 81.3 tttt 72.53 29.8 2.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.833 1.253 . . . . 61.23 109.831 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.08 146.81 35.01 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.725 -1.125 . . . . 72.12 109.123 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . 0.443 ' HB3' ' CE2' ' A' ' 517' ' ' TYR . 9.0 p30 -87.28 137.28 32.47 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 120.525 -0.47 . . . . 43.5 111.171 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.5 ttt -125.42 91.65 3.46 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.511 -1.292 . . . . 74.04 107.511 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.6 -86.75 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.764 -1.107 . . . . 74.21 112.505 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.37 -27.16 13.61 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 113.424 0.898 . . . . 63.53 113.424 -172.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -130.6 157.84 41.63 Favored 'General case' 0 C--N 1.274 -2.69 0 CA-C-N 115.854 -0.612 . . . . 72.24 110.836 -167.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . 0.443 ' CE2' ' HB3' ' A' ' 512' ' ' ASN . 97.6 m-85 -95.56 125.85 40.44 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.152 -0.684 . . . . 75.51 109.152 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 66.7 t -106.92 117.24 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.543 0 CA-C-N 114.994 -1.003 . . . . 74.33 109.764 -175.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -81.7 110.6 17.19 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 107.125 -1.435 . . . . 52.14 107.125 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . 0.421 HG22 HD22 ' A' ' 449' ' ' LEU . 75.4 t -103.57 107.65 22.7 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 107.388 -1.338 . . . . 71.24 107.388 177.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -116.43 144.25 44.54 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.965 -0.754 . . . . 73.21 108.965 -175.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -89.04 123.8 33.68 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.769 -1.197 . . . . 55.1 107.769 -175.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 88.7 m -132.37 174.07 10.63 Favored 'General case' 0 C--N 1.283 -2.31 0 N-CA-C 113.434 0.902 . . . . 64.22 113.434 -169.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.0 t -103.6 154.09 19.88 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.096 -0.956 . . . . 73.02 111.779 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -69.49 -17.26 63.59 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.285 -0.871 . . . . 72.41 109.853 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.42 -46.28 33.68 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.875 -0.602 . . . . 72.31 109.725 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -71.57 -28.64 63.98 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.867 -0.79 . . . . 74.43 108.867 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' MET . . . . . 0.566 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.4 ttt -59.27 -51.64 69.07 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.392 -0.822 . . . . 75.24 109.213 174.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.92 -35.92 82.26 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.435 -0.802 . . . . 70.31 110.144 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.98 -47.79 83.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.533 -0.758 . . . . 72.31 110.583 175.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.15 -35.72 72.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.46 -0.336 . . . . 71.41 110.889 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 528' ' ' MET . 77.4 mt . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 121.165 0.507 . . . . 73.43 110.018 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 C--O 1.248 0.988 0 CA-C-O 121.265 0.555 . . . . 74.41 110.894 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.555 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 8.0 ptp180 -83.89 65.35 8.58 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 122.024 0.916 . . . . 72.31 112.062 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -103.34 6.23 37.77 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.118 -0.946 . . . . 75.14 111.225 -178.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 38.4 m -107.91 155.08 20.69 Favored 'General case' 0 N--CA 1.415 -2.185 0 N-CA-C 108.852 -0.795 . . . . 53.11 108.852 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -132.57 141.18 45.8 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.379 0 N-CA-C 106.99 -1.485 . . . . 73.35 106.99 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.5 ttp180 -116.24 123.61 48.15 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.863 -0.792 . . . . 74.24 108.863 173.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 1.6 mt -97.5 135.14 39.78 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 105.82 -1.919 . . . . 75.43 105.82 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -136.39 135.0 38.41 Favored 'General case' 0 C--N 1.287 -2.126 0 C-N-CA 119.771 -0.772 . . . . 50.33 110.889 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 107.11 23.97 6.78 Favored Glycine 0 N--CA 1.432 -1.627 0 N-CA-C 110.399 -1.081 . . . . 52.01 110.399 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.72 144.61 97.88 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 112.965 0.728 . . . . 73.03 112.965 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -55.19 149.54 44.25 Favored 'Trans proline' 0 CA--C 1.492 -1.591 0 C-N-CA 123.107 2.538 . . . . 63.01 112.182 175.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -77.34 106.63 9.21 Favored 'General case' 1 N--CA 1.37 -4.465 0 N-CA-C 106.123 -1.806 . . . . 72.22 106.123 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 92.52 31.19 0.01 OUTLIER 'General case' 0 C--N 1.282 -2.343 0 CA-C-N 111.299 -2.682 . . . . 62.43 112.469 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.7 117.32 12.07 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.269 -1.382 . . . . 75.43 107.269 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.0 p -88.25 173.94 8.49 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.063 0.459 . . . . 65.31 111.722 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.442 ' O ' HD21 ' A' ' 462' ' ' LEU . 2.5 pp -64.02 -18.55 22.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.55 0.69 . . . . 73.43 111.881 175.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -79.85 -40.43 28.45 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 109.221 -0.659 . . . . 72.22 109.221 175.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.3 -43.58 94.28 Favored 'General case' 0 CA--C 1.497 -1.069 0 CA-C-N 115.859 -0.61 . . . . 53.01 110.731 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 458' ' ' ILE . 15.9 tt -68.93 -32.83 56.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.572 -0.74 . . . . 74.25 111.173 -176.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 458' ' ' ILE . 3.9 mm? -74.54 -36.3 63.14 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.79 0.328 . . . . 64.21 110.679 176.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.13 -47.97 82.19 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 108.789 -0.819 . . . . 74.12 108.789 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -52.56 -42.06 64.11 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 113.461 -1.699 . . . . 74.23 111.37 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 83.0 mt -63.63 -37.17 86.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.924 -0.58 . . . . 60.22 112.391 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.36 -130.33 18.4 Favored Glycine 0 CA--C 1.484 -1.844 0 C-N-CA 119.773 -1.203 . . . . 62.42 111.765 -177.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.92 -26.67 66.12 Favored 'General case' 0 C--N 1.274 -2.689 0 C-N-CA 124.463 1.105 . . . . 74.52 112.093 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -71.38 -11.73 61.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 74.32 111.511 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.36 -15.54 62.87 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.16 -0.473 . . . . 72.35 111.48 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.2 m -78.2 -28.05 47.95 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-O 121.099 0.476 . . . . 74.15 110.253 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -100.46 10.8 40.7 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.623 0.725 . . . . 74.11 111.507 -172.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 13.4 tt -67.94 142.92 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 N-CA-C 109.504 -0.554 . . . . 74.24 109.504 178.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -66.67 155.8 36.98 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.898 -1.149 . . . . 62.54 107.898 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 86.9 m -64.46 106.66 1.18 Allowed 'General case' 0 C--N 1.296 -1.744 0 O-C-N 123.403 0.439 . . . . 74.43 109.995 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 12.2 m170 64.2 27.78 13.96 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.988 0.915 . . . . 74.45 109.859 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.5 -19.32 70.74 Favored Glycine 0 C--N 1.337 0.621 0 CA-C-N 114.955 -1.021 . . . . 60.14 114.055 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.4 p -76.2 118.88 23.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-O 121.455 0.645 . . . . 63.51 110.403 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -134.07 111.49 10.4 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.809 -0.811 . . . . 74.21 108.809 -178.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 76.4 mtp -88.31 139.57 30.35 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.727 -0.789 . . . . 73.23 109.311 179.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.0 t -83.71 100.96 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 108.27 -1.011 . . . . 73.21 108.27 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.45 146.82 23.84 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.69 -1.226 . . . . 75.21 107.69 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -89.17 -172.97 3.86 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 108.304 -0.999 . . . . 64.4 108.304 -176.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -63.61 -26.83 68.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.104 0.478 . . . . 71.33 111.048 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -74.87 -7.21 52.82 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-O 121.482 0.658 . . . . 73.15 110.763 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.0 30.9 62.55 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.793 -0.523 . . . . 71.24 111.793 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -131.06 150.75 77.46 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 106.993 -1.484 . . . . 73.11 106.993 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.42 125.04 17.56 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 122.968 2.445 . . . . 72.03 114.2 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 38.4 m -69.31 -28.62 66.42 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.276 -0.875 . . . . 73.14 110.246 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 133.41 -21.07 4.1 Favored Glycine 0 CA--C 1.493 -1.307 0 CA-C-N 115.59 -0.732 . . . . 52.44 111.526 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . 0.435 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 20.3 p-10 -110.72 151.87 27.23 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.336 0.589 . . . . 64.22 111.302 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.77 155.27 36.86 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.662 -0.866 . . . . 64.22 108.662 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . 0.456 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 77.6 m-85 -111.48 142.11 44.18 Favored 'General case' 0 C--N 1.284 -2.255 0 CA-C-O 121.063 0.459 . . . . 73.53 110.456 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 67.8 mt -126.8 139.72 51.02 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 105.399 -2.074 . . . . 62.45 105.399 173.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -121.16 136.16 55.03 Favored 'General case' 0 C--N 1.274 -2.715 0 C-N-CA 119.905 -0.718 . . . . 71.0 109.443 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -103.9 173.7 6.19 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 123.686 0.616 . . . . 72.04 110.242 176.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -70.26 -42.08 72.62 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-O 121.197 0.522 . . . . 75.32 110.103 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' SER . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 500' ' ' ARG . 36.6 t -130.38 156.82 44.08 Favored 'General case' 0 N--CA 1.412 -2.331 0 CA-C-N 115.587 -0.733 . . . . 71.31 111.141 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.45 -28.36 66.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.79 -1.095 . . . . 75.42 111.262 -177.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.21 -47.82 84.35 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 116.185 -0.461 . . . . 75.54 111.434 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 497' ' ' SER . 0.5 OUTLIER -74.18 -32.75 63.2 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.031 -0.668 . . . . 74.12 111.076 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.34 96.34 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 123.447 0.467 . . . . 73.54 110.352 177.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -65.65 -42.6 91.24 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.869 -0.605 . . . . 74.31 110.038 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 16.0 tpt -67.91 -37.62 81.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.01 -0.541 . . . . 65.42 110.508 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.62 92.8 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.322 -0.399 . . . . 73.05 109.98 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.84 -38.71 86.93 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-O 120.72 0.295 . . . . 74.4 111.022 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -67.32 -41.38 85.38 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.831 0.348 . . . . 61.25 110.583 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -68.38 -39.59 81.69 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.869 -0.605 . . . . 54.04 110.79 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . 0.457 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 49.1 m -99.35 14.22 30.45 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 113.187 0.81 . . . . 71.13 113.187 -175.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -64.83 105.01 0.92 Allowed 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.013 -0.736 . . . . 72.22 109.013 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt 69.9 20.5 6.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.613 1.165 . . . . 61.53 111.648 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . 0.457 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 26.5 tptp -70.83 142.17 51.29 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 124.073 0.949 . . . . 71.3 109.076 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -97.97 143.28 28.71 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 119.319 -0.952 . . . . 62.11 110.848 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 44.3 ttm -111.16 114.32 27.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 104.544 -2.391 . . . . 72.13 104.544 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 97.4 mttt 67.16 -85.42 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.344 1.027 . . . . 64.41 109.011 -172.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -137.73 -8.89 1.63 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.466 0.65 . . . . 75.44 111.043 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -92.3 135.17 34.24 Favored 'General case' 0 CA--C 1.485 -1.524 0 N-CA-C 109.0 -0.741 . . . . 74.4 109.0 -175.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -87.01 132.25 33.85 Favored 'General case' 0 C--N 1.259 -3.335 0 CA-C-N 115.586 -0.734 . . . . 74.32 109.678 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 57.6 t -122.43 127.3 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 N-CA-C 108.727 -0.842 . . . . 70.52 108.727 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -93.68 115.6 28.06 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.742 -1.207 . . . . 73.34 107.742 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 94.3 t -104.34 127.06 58.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 CA-C-N 116.392 -0.367 . . . . 62.43 110.93 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -131.53 150.91 51.98 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.008 -0.542 . . . . 75.33 110.766 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -82.7 156.63 23.69 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.168 0.587 . . . . 62.05 110.098 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 66.0 m -157.23 166.56 32.82 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 122.966 0.506 . . . . 74.14 110.163 -176.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 58.5 p -97.06 155.28 16.87 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.916 -0.584 . . . . 65.31 110.32 177.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.45 62.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.127 -0.488 . . . . 61.05 111.688 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.99 -45.91 66.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.575 -0.528 . . . . 74.55 109.575 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.06 -41.7 97.26 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.418 0.628 . . . . 74.13 109.58 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -60.39 -44.41 95.69 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.788 -1.096 . . . . 73.31 110.81 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.13 -40.74 78.09 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.657 -0.498 . . . . 71.0 109.657 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.3 -41.94 97.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.903 -0.59 . . . . 74.41 110.986 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 96.0 t -72.6 -35.85 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 120.71 -0.396 . . . . 74.35 110.766 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 78.6 mt . . . . . 0 C--N 1.323 -0.583 0 CA-C-O 121.302 0.573 . . . . 73.13 111.399 179.547 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 52.5 t . . . . . 0 C--O 1.245 0.858 0 N-CA-C 108.674 -0.862 . . . . 75.33 108.674 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.564 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 32.3 mtp180 -93.67 67.82 3.92 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 119.645 -0.822 . . . . 73.1 109.353 178.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -99.2 12.54 35.88 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.589 -0.732 . . . . 73.1 110.966 -175.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 27.8 m -117.03 149.5 40.18 Favored 'General case' 0 N--CA 1.412 -2.325 0 N-CA-C 108.646 -0.872 . . . . 74.44 108.646 -178.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . 0.712 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.3 mt -126.96 151.03 33.33 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.76 0 N-CA-C 107.056 -1.461 . . . . 53.02 107.056 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -125.36 124.81 42.35 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.808 -1.182 . . . . 73.11 107.808 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 15.2 mt -100.78 142.66 31.94 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 107.117 -1.438 . . . . 73.14 107.117 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -144.3 126.99 16.14 Favored 'General case' 0 C--N 1.284 -2.263 0 CA-C-O 121.849 0.833 . . . . 74.41 110.669 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 108.63 32.75 3.05 Favored Glycine 0 C--N 1.279 -2.637 0 CA-C-N 114.754 -1.112 . . . . 61.43 110.781 -177.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 95.4 mt -59.98 140.93 90.23 Favored Pre-proline 0 C--O 1.241 0.616 0 N-CA-C 112.07 0.396 . . . . 73.14 112.07 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -61.08 170.57 4.75 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.104 2.536 . . . . 63.54 113.874 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.95 93.13 4.38 Favored 'General case' 0 N--CA 1.403 -2.785 0 CA-C-N 113.573 -1.649 . . . . 72.33 109.694 178.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 83.06 28.89 0.09 Allowed 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 113.007 -1.906 . . . . 70.03 112.695 171.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -61.4 132.67 54.25 Favored 'General case' 0 C--O 1.246 0.907 0 N-CA-C 108.686 -0.857 . . . . 65.53 108.686 173.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 73.1 p -95.97 176.52 6.08 Favored 'General case' 0 N--CA 1.418 -2.028 0 CA-C-O 121.695 0.759 . . . . 74.41 112.362 -174.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.478 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 31.9 pt -65.02 -26.32 39.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.06 0 CA-C-N 115.071 -0.968 . . . . 74.02 111.536 176.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -76.85 -32.29 57.43 Favored 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 119.473 -0.891 . . . . 74.45 110.19 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.84 -42.35 99.71 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.984 -0.553 . . . . 72.12 110.15 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 458' ' ' ILE . 11.8 tt -69.03 -36.03 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 120.606 -0.437 . . . . 71.45 110.666 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 97.6 mt -67.49 -38.99 85.19 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 120.951 0.405 . . . . 73.23 110.246 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -62.51 -51.3 67.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.464 -0.789 . . . . 63.5 109.327 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 94.4 t80 -55.94 -39.4 71.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 113.912 -1.495 . . . . 75.34 111.42 -178.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 71.5 mt -71.31 -32.78 69.02 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.765 -0.652 . . . . 63.21 112.666 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 73.28 -134.06 19.07 Favored Glycine 0 CA--C 1.48 -2.101 0 C-N-CA 119.252 -1.452 . . . . 51.11 111.244 -178.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -64.55 -21.57 66.73 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-N 114.629 -0.785 . . . . 54.41 111.158 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -67.08 -14.18 62.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.277 0.56 . . . . 74.33 110.535 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . 0.426 ' O ' HG23 ' A' ' 472' ' ' ILE . . . -71.27 -14.84 62.36 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.025 -0.534 . . . . 63.22 111.151 177.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 27.7 m -84.17 -23.98 30.37 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-O 121.776 0.798 . . . . 72.01 109.028 176.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -90.92 -11.27 39.62 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.44 -0.8 . . . . 72.34 111.999 -175.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . 0.426 HG23 ' O ' ' A' ' 469' ' ' ALA . 9.5 tt -77.17 132.92 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 N-CA-C 108.868 -0.79 . . . . 63.01 108.868 176.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 -72.71 159.34 33.97 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.942 -0.392 . . . . 71.1 109.942 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 72.1 m -57.18 113.1 1.58 Allowed 'General case' 0 C--O 1.246 0.92 0 CA-C-O 121.286 0.565 . . . . 75.32 111.761 -174.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 62.82 37.35 12.38 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 114.329 -1.305 . . . . 75.12 108.764 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -70.46 -14.29 71.84 Favored Glycine 0 N--CA 1.436 -1.356 0 CA-C-N 115.062 -0.972 . . . . 62.15 111.707 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.46 ' HA ' ' O ' ' A' ' 492' ' ' PHE . 4.2 p -83.38 101.85 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.87 0 CA-C-O 122.089 0.947 . . . . 74.31 110.588 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -107.78 101.87 11.13 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.45 -0.944 . . . . 75.45 108.45 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' MET . . . . . 0.494 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 46.5 ttm -80.59 137.09 36.35 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 120.908 0.385 . . . . 64.12 110.95 -177.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 59.5 t -90.36 111.46 23.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 CA-C-N 115.682 -0.69 . . . . 44.01 110.529 -177.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 2.2 pp -92.91 156.9 16.65 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.289 -0.868 . . . . 60.54 110.415 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -97.21 -169.03 1.79 Allowed 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.891 -1.522 . . . . 63.02 106.891 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -60.02 -30.17 68.99 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 123.342 0.657 . . . . 70.44 111.49 -178.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -73.63 -17.83 61.11 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.039 0.447 . . . . 73.42 110.891 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 89.77 19.41 47.98 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.481 -0.866 . . . . 71.5 111.884 -177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . 0.44 ' HD3' ' O ' ' A' ' 487' ' ' PRO . 0.1 OUTLIER -118.85 146.7 40.71 Favored Pre-proline 0 N--CA 1.445 -0.676 0 N-CA-C 107.211 -1.403 . . . . 75.51 107.211 179.252 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . 0.494 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 10.2 Cg_endo -53.39 133.2 52.15 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 C-N-CA 123.325 2.684 . . . . 75.34 113.265 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 21.1 m -80.02 0.02 33.54 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.674 0.75 . . . . 74.34 109.509 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 94.02 2.07 64.73 Favored Glycine 0 N--CA 1.426 -1.998 0 N-CA-C 110.411 -1.076 . . . . 53.52 110.411 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . 0.467 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 18.0 t70 -114.61 146.19 41.11 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.313 -1.366 . . . . 74.04 107.313 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -160.17 162.59 33.92 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 109.619 -0.512 . . . . 70.23 109.619 -177.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . 0.46 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 87.3 m-85 -115.73 145.87 42.4 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 120.646 0.26 . . . . 71.15 110.558 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.1 mt -118.07 134.88 60.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 105.988 -1.856 . . . . 74.44 105.988 172.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -118.72 109.66 16.35 Favored 'General case' 0 C--N 1.27 -2.861 0 N-CA-C 109.414 -0.587 . . . . 73.12 109.414 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' MET . . . . . 0.712 ' SD ' HD11 ' A' ' 447' ' ' ILE . 71.8 mtp -104.11 169.15 8.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.957 -0.565 . . . . 74.35 111.043 -175.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.22 -53.13 60.76 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 123.441 0.697 . . . . 74.0 111.775 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -121.2 146.04 47.2 Favored 'General case' 0 N--CA 1.419 -2.009 0 CA-C-N 115.669 -0.696 . . . . 64.34 112.142 -169.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.96 66.57 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-N 114.949 -1.023 . . . . 72.31 109.997 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -68.17 -46.91 69.45 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 122.103 0.954 . . . . 74.42 109.339 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -68.71 -38.78 80.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 114.02 -1.446 . . . . 75.04 109.274 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.14 -38.32 87.85 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.33 -0.85 . . . . 73.13 110.603 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -64.27 -42.54 96.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.585 -0.524 . . . . 73.43 109.585 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.3 mtp -61.88 -43.41 98.91 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.389 -0.369 . . . . 71.44 110.244 178.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.3 96.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.494 -0.775 . . . . 73.01 110.7 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.11 -30.28 67.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.969 0.414 . . . . 43.32 111.382 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -46.56 64.01 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.866 -0.606 . . . . 64.53 110.247 176.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . 0.497 ' HE3' ' HA ' ' A' ' 507' ' ' LYS . 1.4 tpmt? -75.7 -31.99 59.92 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.085 0.469 . . . . 73.41 110.582 -175.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 44.1 m -96.41 9.14 42.2 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 120.967 0.413 . . . . 73.43 111.918 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -63.47 101.85 0.37 Allowed 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.294 -0.632 . . . . 73.12 109.294 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 54.54 66.52 1.21 Allowed 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.532 1.533 . . . . 71.1 110.138 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -97.11 141.89 29.71 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 113.634 -1.621 . . . . 51.02 109.49 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . 0.422 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 0.8 OUTLIER -92.72 116.53 29.1 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 108.214 -1.032 . . . . 71.41 108.214 175.115 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.0 ttt -103.6 103.91 13.91 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 107.336 -1.357 . . . . 71.23 107.336 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 89.0 mttt 67.57 -77.91 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.372 1.069 . . . . 75.44 109.791 -175.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -135.4 -12.17 2.11 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 123.444 0.697 . . . . 60.22 110.926 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 28.2 tpt180 -88.83 152.75 21.57 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.035 -0.53 . . . . 72.14 109.723 -172.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.82 118.21 36.02 Favored 'General case' 0 C--N 1.291 -1.96 0 N-CA-C 107.356 -1.35 . . . . 72.44 107.356 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 60.0 t -114.5 116.98 54.2 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 109.046 -0.724 . . . . 61.11 109.046 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -95.95 110.87 23.01 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.604 -0.887 . . . . 71.24 108.604 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.51 135.21 44.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-N 115.999 -0.546 . . . . 62.01 111.868 -177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -126.35 162.22 26.02 Favored 'General case' 0 C--O 1.215 -0.728 0 C-N-CA 124.35 1.06 . . . . 72.13 109.19 176.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -100.71 157.61 16.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.815 -0.809 . . . . 73.24 108.815 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -156.68 163.43 39.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-O 121.892 0.853 . . . . 65.22 111.501 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 3.6 m -97.74 158.81 15.3 Favored 'General case' 0 C--N 1.271 -2.839 0 CA-C-N 114.722 -1.126 . . . . 63.51 108.555 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -57.24 -33.88 68.02 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 122.019 0.914 . . . . 72.23 108.869 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.4 -41.34 98.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.375 -1.284 . . . . 64.43 110.29 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . 0.427 ' O ' HG22 ' A' ' 531' ' ' VAL . 38.3 mt-10 -69.95 -36.53 75.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.213 -0.448 . . . . 73.45 110.095 178.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 46.2 ttm -63.7 -43.7 95.84 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.162 -0.681 . . . . 63.0 109.162 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -61.55 -40.28 94.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.212 -0.904 . . . . 74.14 109.593 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -63.69 -41.3 98.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.994 -0.548 . . . . 71.03 110.643 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 527' ' ' GLU . 98.9 t -65.35 -31.44 53.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.143 0.497 . . . . 63.22 110.499 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.304 -1.39 0 CA-C-O 121.317 0.579 . . . . 73.44 111.126 175.638 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.434 -1.265 0 N-CA-C 106.377 -1.712 . . . . 71.5 106.377 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.553 ' HA ' ' HA ' ' A' ' 524' ' ' SER 0.258 9.4 ptm85 -92.98 73.95 4.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 114.51 1.3 . . . . 72.23 114.51 -176.265 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.66 9.27 17.8 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.097 -0.956 . . . . 71.12 108.898 177.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 17.2 m -107.53 143.88 35.31 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 115.507 -0.769 . . . . 73.1 108.926 -176.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . 0.436 HD12 ' SD ' ' A' ' 495' ' ' MET . 3.2 mt -120.95 148.49 24.17 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.79 0 C-N-CA 123.758 0.823 . . . . 71.33 110.09 -176.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -126.58 122.52 35.3 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 107.254 -1.388 . . . . 74.15 107.254 176.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . 0.412 HD21 HG23 ' A' ' 520' ' ' VAL . 27.5 mt -108.55 153.71 22.98 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.267 -0.642 . . . . 64.43 109.267 -175.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . 0.414 ' HD2' ' OE2' ' A' ' 519' ' ' GLU . 32.6 ttm180 -142.15 147.56 36.85 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 107.402 -1.332 . . . . 61.4 107.402 172.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 86.24 34.61 12.08 Favored Glycine 0 C--N 1.306 -1.124 0 C-N-CA 120.304 -0.95 . . . . 61.53 114.045 175.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 86.4 mt -82.3 142.34 47.01 Favored Pre-proline 0 C--N 1.302 -1.476 0 N-CA-C 109.015 -0.735 . . . . 74.42 109.015 174.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.58 163.74 2.56 Favored 'Trans proline' 0 C--O 1.252 1.221 0 C-N-CA 123.126 2.551 . . . . 75.53 112.721 176.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -71.95 93.48 1.36 Allowed 'General case' 0 N--CA 1.412 -2.35 0 CA-C-N 114.538 -1.21 . . . . 74.33 110.094 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 78.66 36.46 0.19 Allowed 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 112.105 -2.316 . . . . 53.33 111.815 171.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -57.51 130.95 48.63 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.924 -1.139 . . . . 62.02 107.924 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.89 164.63 26.35 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-O 120.827 0.346 . . . . 64.23 110.439 -173.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.476 ' O ' HG23 ' A' ' 461' ' ' ILE . 61.0 mt -62.44 -35.43 69.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.848 0.832 . . . . 73.4 109.686 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -69.17 -29.96 68.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.762 -0.654 . . . . 61.14 110.512 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.62 -39.15 70.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.431 -0.804 . . . . 74.04 110.657 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.476 HG23 ' O ' ' A' ' 458' ' ' ILE . 13.4 tt -74.99 -33.41 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 116.237 -0.438 . . . . 60.21 110.455 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.26 -36.2 79.05 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.236 0.541 . . . . 74.4 110.059 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -61.11 -50.96 71.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.026 -0.988 . . . . 73.43 108.886 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -55.73 -38.85 70.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 113.847 -1.524 . . . . 62.43 111.739 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 87.1 mt -64.42 -35.27 80.36 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.114 -0.494 . . . . 62.14 111.901 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 68.52 -132.65 27.42 Favored Glycine 0 CA--C 1.48 -2.102 0 C-N-CA 119.776 -1.202 . . . . 51.41 112.685 178.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.97 -32.3 45.41 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.131 -1.035 . . . . 73.13 112.242 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -69.34 -14.38 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.083 0.468 . . . . 72.14 111.88 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . 0.486 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -69.96 -15.45 63.04 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.016 0.436 . . . . 65.42 110.596 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 21.0 m -77.11 -24.05 51.75 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 122.237 -0.289 . . . . 74.22 111.757 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . 0.412 ' OD2' ' HB3' ' A' ' 496' ' ' LYS . 30.6 t70 -106.2 -3.13 21.71 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.946 -0.471 . . . . 72.45 111.728 -178.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 469' ' ' ALA . 10.6 tt -59.84 146.11 10.63 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 CA-C-O 120.928 0.394 . . . . 72.12 110.771 -176.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . 0.451 ' NH2' ' HA ' ' A' ' 496' ' ' LYS . 15.2 tpp180 -74.1 139.38 44.56 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 105.773 -1.936 . . . . 73.25 105.773 175.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 21.4 m -72.03 116.42 12.42 Favored 'General case' 0 C--N 1.278 -2.536 0 N-CA-C 109.655 -0.498 . . . . 73.12 109.655 -173.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 9.6 m170 67.19 21.93 9.88 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.789 0.835 . . . . 74.25 111.554 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.79 -6.06 88.81 Favored Glycine 0 N--CA 1.439 -1.12 0 CA-C-N 115.252 -0.886 . . . . 61.3 111.316 177.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.4 p -84.44 119.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 CA-C-O 121.169 0.509 . . . . 70.23 109.921 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -134.69 120.52 19.6 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.05 -0.722 . . . . 74.54 109.05 -178.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 65.8 mtt -97.59 147.75 23.98 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 108.243 -1.021 . . . . 73.42 108.243 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.1 t -94.95 109.46 22.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 CA-C-O 121.602 0.715 . . . . 73.32 110.671 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 2.9 mp -98.87 146.49 25.91 Favored 'General case' 0 N--CA 1.427 -1.598 0 N-CA-C 107.545 -1.279 . . . . 75.04 107.545 172.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -90.08 -179.82 5.76 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.826 -1.546 . . . . 71.25 106.826 -175.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.9 -16.35 64.26 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 114.371 1.248 . . . . 65.35 114.371 -173.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -81.61 -10.08 59.52 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.515 0.674 . . . . 70.43 109.484 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.72 32.1 25.2 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.513 -0.767 . . . . 75.23 111.589 -177.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 30.3 mmt180 -119.31 131.87 24.2 Favored Pre-proline 0 C--N 1.309 -1.193 0 N-CA-C 107.959 -1.126 . . . . 74.12 107.959 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.47 129.76 35.57 Favored 'Trans proline' 0 C--O 1.243 0.76 0 C-N-CA 122.226 1.951 . . . . 74.11 111.205 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 8.0 p -73.95 -28.44 61.5 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.83 0.824 . . . . 72.53 108.982 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 120.72 -15.08 9.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 114.89 -1.05 . . . . 65.22 111.455 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -100.39 161.37 13.64 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 120.932 0.396 . . . . 71.14 110.155 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -159.38 177.56 10.85 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.923 -0.581 . . . . 73.52 109.818 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -135.12 143.03 46.35 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 124.566 1.147 . . . . 73.02 108.657 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 53.7 mt -139.73 135.77 39.17 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 N-CA-C 107.143 -1.429 . . . . 74.24 107.143 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -111.59 138.48 48.07 Favored 'General case' 0 C--N 1.272 -2.785 0 C-N-CA 118.934 -1.106 . . . . 75.02 108.415 175.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' MET . . . . . 0.436 ' SD ' HD12 ' A' ' 447' ' ' ILE . 79.0 mtp -104.71 -176.75 3.17 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.724 -0.843 . . . . 61.14 108.724 175.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.451 ' HA ' ' NH2' ' A' ' 473' ' ' ARG . 3.2 ttmp? -88.21 -39.31 14.57 Favored 'General case' 0 C--N 1.281 -2.384 0 CA-C-O 121.338 0.589 . . . . 61.04 109.642 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 15.6 m -114.26 141.67 47.27 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 115.1 -0.954 . . . . 75.23 111.502 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.11 67.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.207 -0.906 . . . . 62.24 109.02 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -67.27 -45.69 75.87 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-N 114.813 -1.085 . . . . 61.2 110.544 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -70.76 -36.19 72.98 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.507 -0.77 . . . . 70.35 110.346 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -61.67 -41.46 97.57 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 123.551 0.532 . . . . 70.14 110.331 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -62.24 -43.69 98.26 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.918 -0.583 . . . . 75.54 110.935 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 89.7 mtp -65.05 -41.24 95.35 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.172 -0.467 . . . . 74.05 110.516 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.81 -42.53 94.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.145 -0.48 . . . . 61.52 110.461 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.05 -38.49 85.92 Favored 'General case' 0 C--O 1.195 -1.807 0 CA-C-N 116.134 -0.484 . . . . 63.22 111.056 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.95 -42.84 72.7 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.476 0.655 . . . . 72.45 110.072 178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -68.29 -34.31 75.93 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.668 -0.696 . . . . 61.41 110.55 -177.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 34.7 m -115.1 19.01 16.0 Favored 'General case' 0 N--CA 1.425 -1.714 0 N-CA-C 112.993 0.738 . . . . 71.51 112.993 -174.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 34.7 t-80 -69.23 93.51 0.62 Allowed 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.511 -0.743 . . . . 71.24 110.299 176.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 45.6 tttp 71.0 30.04 2.83 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.399 1.479 . . . . 65.15 109.717 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.08 141.91 40.03 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.25 -1.341 . . . . 75.15 108.919 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -77.63 145.79 36.53 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-O 121.256 0.551 . . . . 65.42 110.797 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -129.77 102.17 6.21 Favored 'General case' 0 C--N 1.288 -2.091 0 N-CA-C 106.35 -1.722 . . . . 54.13 106.35 173.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 66.1 -81.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 124.712 1.205 . . . . 63.45 111.958 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -134.76 -2.37 2.66 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 123.399 0.68 . . . . 64.21 112.07 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -115.02 161.39 18.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 107.784 -1.191 . . . . 73.01 107.784 -176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -113.36 121.43 44.33 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.705 -0.479 . . . . 75.43 109.705 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 59.2 t -99.11 112.76 32.11 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.183 0 O-C-N 124.161 0.913 . . . . 71.45 108.638 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . 0.414 ' OE2' ' HD2' ' A' ' 450' ' ' ARG . 49.7 mt-10 -96.29 112.71 24.36 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.146 -1.057 . . . . 71.42 108.146 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . 0.412 HG23 HD21 ' A' ' 449' ' ' LEU . 93.6 t -104.38 115.6 46.59 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.24 0 CA-C-N 115.382 -0.827 . . . . 71.21 109.602 -177.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.99 147.94 32.56 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 108.491 -0.929 . . . . 73.31 108.491 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -105.34 153.36 21.74 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.259 -1.015 . . . . 72.13 108.259 -178.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.8 p -162.79 168.77 20.94 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.259 0.552 . . . . 72.35 111.906 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 69.3 m -91.9 160.14 15.43 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-N 115.359 -0.837 . . . . 62.32 112.444 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -51.73 -36.31 46.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.675 -1.148 . . . . 72.15 111.667 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -64.59 -51.14 64.27 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 108.967 -0.753 . . . . 73.23 108.967 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -39.08 90.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.024 -0.535 . . . . 71.22 111.101 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 528' ' ' MET . . . . . 0.504 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.2 ttt -66.81 -45.15 79.26 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.906 -0.588 . . . . 73.3 110.499 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -71.73 -31.56 66.83 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.806 -0.442 . . . . 75.51 109.806 -176.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -61.31 -47.37 86.24 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 123.899 0.88 . . . . 75.11 110.588 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 48.4 t -70.39 -35.09 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.332 -0.547 . . . . 72.2 109.588 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.2 mt . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.195 -0.457 . . . . 71.24 110.822 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.3 t . . . . . 0 C--O 1.245 0.828 0 N-CA-C 109.537 -0.542 . . . . 71.4 109.537 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.534 ' HG3' ' OG ' ' A' ' 524' ' ' SER . 7.6 mpt_? -102.28 67.02 1.02 Allowed 'General case' 0 C--O 1.209 -1.059 0 N-CA-C 110.026 -0.361 . . . . 73.14 110.026 -176.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -124.82 14.87 8.63 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 112.592 0.59 . . . . 63.11 112.592 -176.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 20.4 m -108.84 151.64 25.98 Favored 'General case' 0 N--CA 1.413 -2.284 0 N-CA-C 108.462 -0.94 . . . . 54.25 108.462 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.81 132.55 69.96 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.722 0 N-CA-C 108.655 -0.868 . . . . 73.53 108.655 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -106.02 121.41 44.07 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 108.356 -0.979 . . . . 75.12 108.356 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 18.3 mt -104.45 150.44 24.56 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.684 -1.228 . . . . 74.42 107.684 -177.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -146.52 131.63 18.32 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.853 -0.425 . . . . 73.03 109.853 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.32 41.06 2.12 Favored Glycine 0 C--N 1.289 -2.036 0 CA-C-N 115.737 -0.665 . . . . 65.54 111.653 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.06 130.85 89.38 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.16 . . . . 73.05 111.388 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.91 156.83 31.39 Favored 'Trans proline' 0 N--CA 1.447 -1.216 0 C-N-CA 122.808 2.339 . . . . 74.32 112.67 176.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -78.14 93.11 4.5 Favored 'General case' 0 N--CA 1.408 -2.537 0 CA-C-N 114.103 -1.408 . . . . 74.31 110.006 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.83 25.76 0.03 OUTLIER 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 112.732 -2.031 . . . . 72.41 113.325 172.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -69.39 135.87 50.9 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.375 -1.342 . . . . 72.15 107.375 172.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.2 p -89.26 174.7 7.69 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-O 120.884 0.373 . . . . 73.43 111.795 -175.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.436 ' O ' HG22 ' A' ' 461' ' ' ILE . 72.8 mt -61.48 -38.05 79.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 N-CA-C 108.886 -0.783 . . . . 71.52 108.886 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -64.73 -37.3 87.14 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.403 -0.817 . . . . 72.32 110.714 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -68.75 -43.4 75.92 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.061 0.458 . . . . 60.3 110.437 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.473 ' O ' ' HG ' ' A' ' 465' ' ' LEU . 12.6 tt -71.85 -33.0 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 CA-C-N 115.839 -0.619 . . . . 53.54 110.621 -175.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 8.1 mp -70.8 -30.64 67.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.9 0.381 . . . . 75.52 110.9 176.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.93 -48.23 66.53 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.207 -1.035 . . . . 61.32 108.207 175.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -54.63 -42.74 71.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.17 -1.377 . . . . 75.33 111.102 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 90.0 mt -64.95 -31.66 73.01 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.811 -0.631 . . . . 72.22 111.811 178.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 85.83 -149.41 23.28 Favored Glycine 0 N--CA 1.422 -2.268 0 C-N-CA 120.51 -0.852 . . . . 72.51 111.431 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -66.31 -22.52 66.28 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.031 -0.585 . . . . 63.41 111.005 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -62.81 -17.44 61.24 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.808 -0.633 . . . . 74.15 111.101 178.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -67.44 -15.32 63.61 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 116.059 -0.519 . . . . 72.54 110.979 178.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.3 m -85.83 -3.27 58.87 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.759 0.79 . . . . 65.31 109.508 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -112.93 13.95 19.65 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.996 -0.547 . . . . 74.32 110.771 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 15.8 tt -72.07 150.63 8.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.282 -0.872 . . . . 74.41 109.017 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -80.34 151.84 29.26 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 109.542 -0.54 . . . . 72.12 109.542 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 1.4 m -59.24 114.41 2.63 Favored 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.881 1.273 . . . . 74.4 109.704 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 59.93 33.21 21.46 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.746 0.818 . . . . 72.55 110.726 -178.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -98.35 37.04 3.64 Favored Glycine 0 N--CA 1.432 -1.584 0 CA-C-N 116.059 -0.519 . . . . 73.13 114.32 -174.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 59.0 t -118.41 111.47 34.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.304 0 N-CA-C 109.016 -0.735 . . . . 72.01 109.016 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 29.9 m-70 -127.65 100.47 5.99 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.243 0.544 . . . . 74.14 111.396 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 66.7 mtt -82.61 142.75 31.51 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.907 -0.775 . . . . 71.34 108.907 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 46.9 t -88.01 107.49 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.685 0 N-CA-C 107.214 -1.402 . . . . 62.22 107.214 176.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.8 pp -93.11 158.51 15.74 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.626 -0.715 . . . . 74.44 112.458 -178.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -91.93 173.2 7.97 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 106.342 -1.725 . . . . 75.13 106.342 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -56.05 -27.46 53.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.184 0.447 . . . . 75.24 111.219 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . 0.43 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 35.3 tt0 -69.41 -20.23 63.8 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 121.161 0.505 . . . . 72.45 111.345 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 90.87 25.58 24.49 Favored Glycine 0 N--CA 1.435 -1.403 0 CA-C-O 121.463 0.48 . . . . 37.03 112.898 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . 0.43 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 91.3 mtt180 -126.79 144.78 51.2 Favored Pre-proline 0 C--N 1.303 -1.445 0 N-CA-C 108.037 -1.097 . . . . 74.2 108.037 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -53.17 136.18 61.26 Favored 'Trans proline' 0 C--O 1.245 0.868 0 C-N-CA 123.113 2.542 . . . . 75.32 113.055 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.2 m -80.01 1.58 27.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.461 -0.79 . . . . 62.11 111.142 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.85 -30.0 6.57 Favored Glycine 0 CA--C 1.488 -1.656 0 N-CA-C 111.235 -0.746 . . . . 72.03 111.235 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -107.22 152.84 23.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.06 0.457 . . . . 70.41 110.86 179.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -158.11 169.38 24.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.498 -0.774 . . . . 71.12 109.184 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -127.71 129.88 47.87 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-N 116.182 -0.463 . . . . 75.25 109.775 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 43.3 mt -122.27 133.01 69.85 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.378 0 N-CA-C 105.977 -1.86 . . . . 74.34 105.977 172.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -108.54 136.57 47.92 Favored 'General case' 0 C--N 1.271 -2.812 0 N-CA-C 109.571 -0.529 . . . . 74.52 109.571 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.72 172.59 6.72 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 123.214 0.606 . . . . 62.13 111.442 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -65.07 -43.93 90.58 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.179 0.991 . . . . 75.13 110.181 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 51.0 p -141.03 155.98 46.09 Favored 'General case' 0 N--CA 1.42 -1.943 0 CA-C-N 116.302 -0.408 . . . . 73.5 111.785 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.54 -40.88 93.14 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.02 -0.991 . . . . 72.34 111.392 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.56 -37.84 87.85 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.093 -0.958 . . . . 71.43 111.932 -174.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -75.94 -40.77 53.39 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.405 -0.816 . . . . 71.4 109.741 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.34 -41.84 98.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.362 -0.835 . . . . 73.14 111.008 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -64.6 -40.06 94.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.855 -0.611 . . . . 74.15 110.978 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 55.6 ttm -70.32 -37.63 74.76 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.303 -0.559 . . . . 65.11 110.304 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.004 -0.544 . . . . 51.33 110.644 178.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.14 -32.18 70.04 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.076 -0.511 . . . . 74.23 111.836 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -72.89 -34.8 66.91 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.335 0.588 . . . . 55.33 109.772 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -68.69 -41.7 78.81 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.438 -0.801 . . . . 73.44 110.778 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 62.2 m -105.5 20.68 18.48 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 112.558 0.577 . . . . 71.13 112.558 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.89 92.32 0.23 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.384 0.611 . . . . 64.1 110.572 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 82.7 tttt 64.31 62.74 0.81 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.501 1.52 . . . . 74.41 110.041 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -105.82 139.38 40.48 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 113.429 -1.714 . . . . 64.45 107.763 179.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -75.78 140.72 42.5 Favored 'General case' 0 C--N 1.293 -1.879 0 CA-C-O 121.216 0.532 . . . . 72.24 111.268 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.7 ttt -126.19 90.68 3.23 Favored 'General case' 0 N--CA 1.415 -2.19 0 N-CA-C 105.576 -2.009 . . . . 75.44 105.576 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp 68.55 -84.86 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.928 -1.487 . . . . 72.44 110.573 -177.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -107.35 -35.87 6.67 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 115.966 -0.561 . . . . 74.54 112.082 -177.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.4 ttm105 -108.63 153.1 23.89 Favored 'General case' 0 C--N 1.273 -2.76 0 CA-C-N 114.992 -1.003 . . . . 65.0 109.833 -165.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -101.2 121.29 41.58 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 121.219 0.533 . . . . 73.22 112.083 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.55 109.97 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.277 0 CA-C-N 114.887 -1.052 . . . . 63.05 108.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -89.41 110.86 21.63 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 107.808 -1.182 . . . . 64.2 107.808 178.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 85.5 t -104.4 123.43 58.27 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.143 0 CA-C-N 115.874 -0.603 . . . . 73.03 109.501 -178.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -122.07 135.32 54.8 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.006 -0.739 . . . . 65.14 109.006 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.85 125.63 35.79 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 106.828 -1.545 . . . . 74.53 106.828 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 62.4 m -134.49 170.31 15.95 Favored 'General case' 0 C--N 1.284 -2.24 0 CA-C-N 115.348 -0.842 . . . . 70.13 111.014 -171.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.534 ' OG ' ' HG3' ' A' ' 444' ' ' ARG . 44.4 m -92.69 164.1 13.52 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 116.278 -0.419 . . . . 53.25 110.721 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.91 -23.05 63.19 Favored 'General case' 0 C--O 1.209 -1.063 0 CA-C-N 115.552 -0.749 . . . . 73.21 111.056 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.55 -50.31 70.0 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.146 -0.479 . . . . 72.4 110.379 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.6 -40.59 95.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.185 0.517 . . . . 70.12 110.607 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 528' ' ' MET . . . . . 0.5 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 27.8 ttt -67.01 -44.43 80.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.631 -0.713 . . . . 70.35 110.417 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.13 -35.95 80.82 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-N 116.12 -0.491 . . . . 71.41 110.164 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -62.73 -46.2 89.17 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.983 -0.553 . . . . 72.31 110.664 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 58.4 t -74.35 -31.79 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 120.327 -0.549 . . . . 73.21 110.911 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 528' ' ' MET . 73.3 mt . . . . . 0 C--N 1.322 -0.61 0 CA-C-O 120.909 0.385 . . . . 74.44 110.869 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.437 -1.076 0 N-CA-C 109.522 -0.548 . . . . 72.11 109.522 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 444' ' ' ARG . . . . . 0.644 ' HB2' ' NE2' ' A' ' 522' ' ' GLN . 22.1 ptt180 -87.25 51.91 2.36 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 122.545 1.164 . . . . 75.14 109.525 176.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -101.93 9.25 40.72 Favored 'General case' 0 C--N 1.3 -1.543 0 CA-C-N 114.144 -1.389 . . . . 75.23 111.288 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 44.3 m -107.54 149.36 28.09 Favored 'General case' 0 N--CA 1.412 -2.351 0 C-N-CA 119.559 -0.857 . . . . 65.03 109.948 -176.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 447' ' ' ILE . . . . . 0.657 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.5 mt -122.08 141.47 42.36 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.936 0 N-CA-C 106.892 -1.522 . . . . 71.05 106.892 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -116.63 124.94 51.01 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 108.101 -1.074 . . . . 74.14 108.101 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.6 mt -108.88 125.46 52.02 Favored 'General case' 0 C--N 1.279 -2.483 0 N-CA-C 106.038 -1.838 . . . . 75.45 106.038 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -136.52 137.26 40.11 Favored 'General case' 0 C--N 1.274 -2.709 0 CA-C-O 121.32 0.581 . . . . 72.4 110.372 -176.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 95.08 23.0 21.36 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 110.279 -1.128 . . . . 61.54 110.279 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.9 mt -60.11 145.46 85.15 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 123.899 0.88 . . . . 73.21 111.932 -178.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -59.98 158.96 27.3 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 C-N-CA 122.836 2.357 . . . . 64.21 113.707 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -77.17 95.1 4.2 Favored 'General case' 0 N--CA 1.396 -3.161 0 CA-C-N 113.004 -1.907 . . . . 75.34 109.683 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 87.74 26.84 0.04 OUTLIER 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 112.362 -2.199 . . . . 71.33 112.926 171.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -67.55 136.2 54.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.579 -0.737 . . . . 60.02 109.228 173.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 5.8 p -85.68 151.9 23.51 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 115.663 -0.699 . . . . 74.45 109.574 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 458' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.253 2.7 pp -62.3 -29.66 47.17 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.763 0 C-N-CA 120.003 -0.679 . . . . 73.34 112.606 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.86 -29.42 67.73 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.884 0.374 . . . . 70.42 111.224 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -75.51 -40.09 57.57 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.929 -0.767 . . . . 60.43 108.929 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' ILE . . . . . 0.404 HG21 ' HA ' ' A' ' 458' ' ' ILE . 12.4 tt -75.07 -28.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 C-N-CA 120.137 -0.625 . . . . 52.23 111.07 -179.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 87.0 mt -63.62 -34.84 78.71 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.676 -0.49 . . . . 75.2 109.676 175.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.19 -48.54 70.33 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.341 -0.985 . . . . 72.33 108.341 176.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.74 -41.18 70.09 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 113.992 -1.458 . . . . 74.22 111.2 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 97.0 mt -69.65 -37.39 76.73 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.013 -0.539 . . . . 75.52 110.325 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 87.29 -146.65 20.36 Favored Glycine 0 N--CA 1.418 -2.509 0 C-N-CA 120.758 -0.734 . . . . 63.24 112.97 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -49.75 -30.54 9.66 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 126.343 1.857 . . . . 73.04 113.275 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -61.62 -19.58 62.41 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.38 0.672 . . . . 72.51 112.368 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -61.9 -15.29 41.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.213 0.82 . . . . 73.43 113.213 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 12.8 t -86.58 -15.02 41.16 Favored 'General case' 0 CA--C 1.551 1.012 0 O-C-N 121.694 -0.629 . . . . 74.32 111.548 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -102.42 13.44 34.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.167 0.984 . . . . 51.3 110.469 -174.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 11.2 tt -73.53 152.62 7.31 Favored 'Isoleucine or valine' 0 C--O 1.248 1.013 0 CA-C-N 115.195 -0.911 . . . . 72.33 109.202 177.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -83.87 144.59 29.13 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 119.836 -0.745 . . . . 71.42 109.126 173.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 20.4 m -59.9 119.31 7.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.783 -0.821 . . . . 72.24 108.783 176.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 36.2 t-80 68.11 21.55 8.65 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.305 1.05 . . . . 72.03 109.257 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.75 -15.99 80.5 Favored Glycine 0 N--CA 1.438 -1.176 0 CA-C-N 115.512 -0.767 . . . . 63.0 112.296 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -83.67 123.81 39.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.445 0.641 . . . . 62.43 110.404 178.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -133.24 117.12 17.02 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.674 -0.861 . . . . 74.11 108.674 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.0 mtt -91.87 145.5 24.5 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-O 120.676 0.274 . . . . 64.23 110.341 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.9 t -84.61 96.33 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.545 0 N-CA-C 105.74 -1.948 . . . . 74.5 105.74 172.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.3 pp -96.03 161.42 13.99 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 114.209 -1.36 . . . . 71.32 113.356 -176.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.02 162.98 16.52 Favored 'General case' 0 C--N 1.282 -2.336 0 N-CA-C 104.098 -2.556 . . . . 71.24 104.098 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 64.3 m80 -70.31 -5.16 25.92 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 119.788 1.176 . . . . 72.25 112.411 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -83.39 -7.02 59.63 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.073 -0.967 . . . . 75.31 109.143 172.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 81.29 29.15 41.68 Favored Glycine 0 CA--C 1.495 -1.218 0 CA-C-N 115.746 -0.661 . . . . 55.44 112.859 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -117.43 127.41 26.69 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 108.669 -0.863 . . . . 61.32 108.669 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.78 126.63 19.39 Favored 'Trans proline' 0 C--O 1.243 0.772 0 C-N-CA 122.347 2.032 . . . . 52.23 111.197 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.6 m -74.95 -2.14 25.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.892 -0.594 . . . . 71.4 112.068 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 107.56 10.93 26.19 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.88 -0.676 . . . . 54.43 111.737 179.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -132.25 138.31 47.86 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.168 -1.419 . . . . 63.15 107.168 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.17 161.37 30.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.868 0.366 . . . . 52.04 110.73 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -122.9 142.81 50.39 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 123.3 0.64 . . . . 72.24 109.3 177.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 60.8 mt -128.62 126.5 65.37 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.228 0 N-CA-C 107.491 -1.299 . . . . 74.22 107.491 174.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -100.19 126.36 46.46 Favored 'General case' 0 C--N 1.275 -2.648 0 N-CA-C 109.539 -0.541 . . . . 51.31 109.539 177.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' MET . . . . . 0.657 ' SD ' HD11 ' A' ' 447' ' ' ILE . 82.9 mtp -100.47 170.38 8.43 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 108.364 -0.976 . . . . 74.44 108.364 177.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -80.82 -35.59 32.72 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.4 -0.592 . . . . 72.43 109.4 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.5 m -122.06 141.36 51.46 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-O 121.469 0.652 . . . . 73.13 111.205 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -76.18 -22.71 55.0 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.9 . . . . 71.44 111.84 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -70.97 -40.93 71.64 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.782 -0.644 . . . . 73.25 110.753 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -38.41 67.2 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.279 -0.873 . . . . 75.0 111.753 173.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . 0.416 ' HA ' ' SD ' ' A' ' 495' ' ' MET . . . -57.81 -44.73 86.54 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.196 0.522 . . . . 53.52 110.779 178.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -63.13 -39.2 94.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.631 -0.713 . . . . 74.52 110.426 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.85 -34.99 72.21 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.64 0.237 . . . . 75.04 111.64 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.15 -43.24 82.83 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.56 -0.533 . . . . 64.14 109.56 177.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -66.45 -29.67 69.85 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.897 -0.592 . . . . 74.23 110.901 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -71.52 -44.69 64.17 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.458 -0.571 . . . . 71.32 109.458 177.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.2 -44.51 96.42 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.611 -0.722 . . . . 73.44 110.347 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 58.9 m -98.71 10.44 41.14 Favored 'General case' 0 N--CA 1.421 -1.907 0 N-CA-C 113.513 0.931 . . . . 53.44 113.513 -173.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 509' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 32.7 t60 -77.06 104.35 7.5 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 119.439 -0.904 . . . . 73.23 109.453 174.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 73.01 19.43 3.7 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.72 1.208 . . . . 74.43 110.617 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.02 146.67 26.55 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.502 -1.296 . . . . 70.01 107.502 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -98.04 149.52 22.38 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 118.666 -1.214 . . . . 75.2 111.673 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.0 ttt -120.17 113.0 19.79 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 104.946 -2.242 . . . . 52.33 104.946 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.3 mttm 69.99 -87.19 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.118 -1.067 . . . . 72.33 108.118 -172.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.25 1.53 1.24 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.314 0.646 . . . . 74.41 111.417 175.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -103.99 142.58 34.19 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 107.566 -1.272 . . . . 74.43 107.566 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -95.24 125.35 39.82 Favored 'General case' 0 C--N 1.265 -3.077 0 CA-C-O 121.489 0.661 . . . . 73.31 110.7 -176.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 61.4 t -102.23 127.39 55.84 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.666 0 N-CA-C 106.881 -1.525 . . . . 72.2 106.881 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -103.77 109.21 20.84 Favored 'General case' 0 N--CA 1.411 -2.404 0 N-CA-C 108.221 -1.029 . . . . 75.44 108.221 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.0 t -106.73 134.28 48.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 CA-C-N 115.15 -0.932 . . . . 61.43 110.623 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -125.33 159.9 30.63 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.437 -0.949 . . . . 73.53 108.437 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 522' ' ' GLN . . . . . 0.644 ' NE2' ' HB2' ' A' ' 444' ' ' ARG . 1.0 OUTLIER -101.68 139.49 37.25 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.392 -1.336 . . . . 42.44 107.392 177.482 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 65.1 m -141.01 169.47 17.54 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.86 0.362 . . . . 62.41 110.724 -175.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.514 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.3 p -99.2 159.96 14.61 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.999 -0.546 . . . . 62.43 109.931 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -56.99 -30.88 64.52 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 123.614 0.571 . . . . 63.41 109.646 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.36 -52.56 57.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.377 1.071 . . . . 55.04 110.068 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -59.68 -42.81 93.75 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.675 0.75 . . . . 74.42 109.076 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 22.1 ttt -62.01 -45.04 95.33 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 114.586 -1.188 . . . . 74.52 110.199 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.99 -39.3 87.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.938 -0.573 . . . . 65.42 109.761 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -68.31 -39.12 82.12 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.079 -0.509 . . . . 71.34 110.764 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 91.5 t -73.3 -38.11 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 C-N-CA 120.233 -0.587 . . . . 63.13 110.469 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 121.204 0.526 . . . . 70.23 111.772 -178.726 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 CA--C 1.513 -0.459 0 N-CA-C 108.034 -1.099 . . . . 61.34 108.034 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.13 127.26 13.29 Favored 'Trans proline' 0 C--O 1.248 1.021 0 C-N-CA 121.858 1.705 . . . . 65.1 111.594 -178.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -60.71 107.02 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.454 2.103 . . . . 53.23 110.419 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 25.8 m -97.61 131.57 44.07 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-N 115.742 -0.663 . . . . 74.24 109.414 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . 0.475 ' OD1' ' HB2' ' A' ' 524' ' ' SER . 51.9 t30 -80.34 95.94 6.52 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.493 -0.558 . . . . 75.45 109.493 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 30.3 t -108.87 153.53 10.56 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 107.401 -1.333 . . . . 55.33 107.401 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.525 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 59.0 mtp85 -90.06 62.25 5.49 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 121.851 0.834 . . . . 74.51 109.813 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.2 p30 -111.43 11.73 21.46 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-N 115.005 -0.998 . . . . 71.41 110.168 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 28.3 m -109.07 151.28 26.6 Favored 'General case' 0 N--CA 1.408 -2.539 0 N-CA-C 107.797 -1.186 . . . . 64.32 107.797 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . 0.428 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.2 mt -132.13 143.9 38.7 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.39 0 N-CA-C 108.354 -0.98 . . . . 64.01 108.354 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -112.29 119.1 37.16 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 108.056 -1.09 . . . . 64.13 108.056 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 10.6 mt -94.42 141.5 28.51 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.505 -2.035 . . . . 71.13 105.505 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . 0.45 ' HE ' ' CG ' ' A' ' 490' ' ' ASP . 0.0 OUTLIER -142.65 135.83 28.48 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 119.53 -0.868 . . . . 75.02 109.861 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.429 ' N ' ' HD3' ' A' ' 450' ' ' ARG . . . 99.51 22.26 13.03 Favored Glycine 0 C--N 1.28 -2.576 0 CA-C-N 114.474 -1.239 . . . . 74.12 112.188 177.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.75 144.59 96.35 Favored Pre-proline 0 C--O 1.242 0.66 0 C-N-CA 122.883 0.473 . . . . 70.41 111.974 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -57.21 160.65 12.73 Favored 'Trans proline' 0 C--O 1.252 1.218 0 C-N-CA 123.395 2.73 . . . . 64.01 113.762 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -77.19 98.61 5.15 Favored 'General case' 0 N--CA 1.401 -2.903 0 CA-C-N 113.952 -1.476 . . . . 73.14 108.686 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.96 30.43 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.485 0 CA-C-N 111.966 -2.379 . . . . 65.51 111.971 172.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -54.2 121.87 9.09 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 108.425 -0.954 . . . . 62.34 108.425 171.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 7.2 p -81.02 169.35 17.61 Favored 'General case' 0 N--CA 1.414 -2.27 0 CA-C-N 115.963 -0.562 . . . . 70.02 111.952 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.647 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 16.2 tt -67.1 -31.69 54.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 CA-C-N 116.185 -0.461 . . . . 74.33 111.957 -174.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -80.25 -28.19 38.52 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.74 -0.784 . . . . 73.42 110.264 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.62 -40.1 80.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.14 -0.936 . . . . 70.11 108.968 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.464 HG23 ' O ' ' A' ' 458' ' ' ILE . 13.5 tt -71.01 -32.88 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 115.41 -0.814 . . . . 75.22 110.065 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 93.1 mt -68.25 -40.08 82.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.327 -0.249 . . . . 75.55 110.327 178.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.97 -52.43 64.2 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 121.502 0.667 . . . . 71.12 109.28 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -53.97 -39.4 65.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.905 -1.498 . . . . 75.13 111.878 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 94.7 mt -72.64 -36.49 68.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.915 -0.584 . . . . 74.04 111.92 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.82 -140.41 25.86 Favored Glycine 0 N--CA 1.43 -1.72 0 C-N-CA 119.85 -1.167 . . . . 52.34 111.855 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.46 -17.85 63.15 Favored 'General case' 0 C--N 1.287 -2.133 0 CA-C-N 114.603 -0.798 . . . . 75.04 113.017 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . 0.41 ' O ' ' HE1' ' A' ' 495' ' ' MET . 95.2 m-85 -70.6 -22.02 62.59 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.352 0.596 . . . . 75.45 110.899 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.4 -14.65 62.65 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.453 0.644 . . . . 73.43 110.521 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 15.9 m -81.68 -18.21 45.31 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 116.201 -0.454 . . . . 74.32 111.222 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -112.97 16.13 19.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.998 0.904 . . . . 74.42 110.672 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -66.81 145.58 13.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.879 0 CA-C-N 115.761 -0.654 . . . . 73.1 109.438 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -78.5 155.29 29.88 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.3 -1.37 . . . . 64.14 107.3 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 12.3 p -54.75 114.22 1.62 Allowed 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 123.426 0.69 . . . . 51.14 111.382 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 63.11 26.19 15.24 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.69 0.796 . . . . 51.24 111.968 -176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.18 70.88 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 116.291 -0.413 . . . . 71.11 113.596 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.2 p -85.7 114.26 25.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.894 0.854 . . . . 73.12 112.245 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -124.78 113.76 18.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.079 -0.964 . . . . 73.15 109.508 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 66.1 mtt -88.94 136.97 32.73 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.924 -0.769 . . . . 74.14 108.924 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.61 121.12 37.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 N-CA-C 108.93 -0.767 . . . . 73.33 108.93 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 85.6 mt -92.95 158.7 15.68 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.756 -0.831 . . . . 75.43 108.756 179.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -106.6 -174.64 2.58 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.78 -1.563 . . . . 74.12 106.78 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -53.8 -39.96 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.771 0.828 . . . . 72.04 111.858 -176.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -68.68 -12.7 61.71 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.563 0.745 . . . . 63.44 111.993 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 84.48 24.21 47.76 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.454 -0.658 . . . . 75.22 111.454 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -127.86 152.86 77.85 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 106.937 -1.505 . . . . 72.43 106.937 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -50.55 135.12 40.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.308 2.672 . . . . 62.13 114.914 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 43.2 t -76.16 -18.75 58.97 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.662 -1.154 . . . . 73.13 109.11 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 102.09 -2.07 51.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 109.091 -1.603 . . . . 74.14 109.091 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . 0.45 ' CG ' ' HE ' ' A' ' 450' ' ' ARG . 8.6 m-20 -104.95 143.65 32.87 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 107.545 -1.279 . . . . 72.34 107.545 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -151.67 148.53 28.05 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 108.737 -0.838 . . . . 61.12 108.737 175.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . 0.401 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 70.1 m-85 -122.43 127.82 50.12 Favored 'General case' 0 C--N 1.282 -2.367 0 N-CA-C 108.692 -0.855 . . . . 73.35 108.692 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.6 mt -124.7 128.23 73.26 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 N-CA-C 109.053 -0.721 . . . . 72.24 109.053 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -102.55 123.82 46.98 Favored 'General case' 0 C--N 1.282 -2.363 0 N-CA-C 109.485 -0.561 . . . . 74.32 109.485 177.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' MET . . . . . 0.428 ' SD ' HD11 ' A' ' 447' ' ' ILE . 80.4 mtp -96.97 171.63 8.37 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.537 -0.756 . . . . 73.42 109.092 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -74.69 -38.29 62.43 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 121.284 0.564 . . . . 53.1 110.074 -177.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.7 m -115.63 141.12 48.49 Favored 'General case' 0 N--CA 1.403 -2.776 0 CA-C-N 115.432 -0.803 . . . . 71.54 110.039 -172.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -75.75 -25.04 56.16 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.334 0.587 . . . . 74.24 110.795 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.6 -40.9 55.74 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.603 -0.726 . . . . 74.3 109.45 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -63.16 -41.48 99.25 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.839 -1.073 . . . . 70.31 110.647 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -59.82 -44.03 94.25 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.503 0.502 . . . . 73.41 110.685 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 75.43 110.468 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 4.2 tpt -62.62 -41.62 99.12 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.005 -0.543 . . . . 75.52 109.845 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.37 -39.9 89.4 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.305 -0.407 . . . . 72.22 110.927 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -72.57 -22.87 60.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.345 -0.389 . . . . 64.5 111.912 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -82.57 -44.6 15.66 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 109.024 -0.732 . . . . 71.32 109.024 176.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.88 -43.24 96.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.722 -1.126 . . . . 73.12 110.045 -178.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 62.8 m -101.6 13.68 34.22 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 115.208 -0.905 . . . . 54.12 112.985 -175.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 25.3 t-80 -68.47 92.19 0.43 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.911 -0.774 . . . . 63.41 108.911 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 81.1 tttt 67.46 70.46 0.36 Allowed 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.871 1.668 . . . . 75.11 109.637 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . 0.411 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 87.1 tttt -105.21 148.08 27.32 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 113.274 -1.785 . . . . 51.2 108.363 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -84.3 117.61 23.67 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.85 -0.74 . . . . 73.44 109.623 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.442 ' SD ' HG21 ' A' ' 518' ' ' VAL . 26.3 ttt -108.37 95.37 5.62 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 106.935 -1.506 . . . . 72.1 106.935 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt 69.57 -79.39 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.335 1.022 . . . . 73.52 111.123 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -135.23 -3.65 2.43 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.944 0.878 . . . . 73.02 110.65 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -109.83 162.1 14.81 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.693 -0.855 . . . . 75.14 108.693 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -112.62 117.7 33.01 Favored 'General case' 0 N--CA 1.426 -1.653 0 N-CA-C 108.277 -1.009 . . . . 65.42 108.277 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . 0.442 HG21 ' SD ' ' A' ' 513' ' ' MET . 95.2 t -106.46 122.12 59.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.887 0 CA-C-N 114.901 -1.045 . . . . 73.23 108.563 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -99.2 114.35 27.1 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 108.434 -0.95 . . . . 71.21 108.434 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 92.6 t -104.87 136.09 40.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 CA-C-N 114.998 -1.001 . . . . 62.01 109.777 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -135.29 141.86 45.76 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.514 -0.921 . . . . 72.01 108.514 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -76.66 154.69 34.03 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 109.452 -0.573 . . . . 72.33 109.452 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.8 m -152.36 169.28 22.92 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.291 0.567 . . . . 75.32 109.535 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.525 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 76.4 p -104.35 164.92 11.4 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 108.178 -1.045 . . . . 72.14 108.178 176.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -54.71 -39.06 67.8 Favored 'General case' 0 C--N 1.307 -1.265 0 O-C-N 123.734 0.646 . . . . 73.44 110.363 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -62.93 -47.19 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.949 -0.569 . . . . 71.12 110.567 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -63.21 -37.16 86.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.374 -0.376 . . . . 73.34 111.446 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' MET . . . . . 0.411 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.3 ttt -62.79 -48.37 79.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.923 -0.58 . . . . 51.41 110.314 177.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -68.36 -34.68 76.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.3 0.571 . . . . 73.14 109.994 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.29 -41.51 96.84 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.26 -0.882 . . . . 74.13 110.906 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 62.7 t -75.98 -35.0 28.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 C-N-CA 119.709 -0.796 . . . . 63.01 110.293 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 528' ' ' MET . 91.4 mt -67.76 -34.86 77.64 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 116.318 -0.401 . . . . 70.52 111.483 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 26.0 ttt -78.62 -18.25 54.8 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 122.036 0.922 . . . . 73.51 110.565 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 75.94 53.68 5.67 Favored Glycine 0 C--N 1.278 -2.663 0 CA-C-N 114.137 -1.392 . . . . 64.32 111.026 -176.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -64.0 164.48 31.95 Favored Glycine 0 N--CA 1.422 -2.282 0 CA-C-N 115.334 -0.433 . . . . 65.33 113.087 178.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 m -74.18 116.02 14.34 Favored 'General case' 0 N--CA 1.431 -1.379 0 C-N-CA 122.8 0.44 . . . . 75.21 110.342 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 61.4 tp -117.62 114.55 23.56 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 108.323 -0.991 . . . . 73.51 108.323 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -79.18 119.51 22.37 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 122.24 1.019 . . . . 75.42 112.052 -176.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 19.7 ttm180 -141.8 102.77 4.23 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 114.805 -1.089 . . . . 75.23 108.312 175.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.43 75.59 4.95 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 122.923 1.344 . . . . 73.24 111.567 177.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.43 -1.437 0 N-CA-C 106.605 -1.628 . . . . 73.1 106.605 -175.714 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.502 0 N-CA-C 107.75 -1.204 . . . . 71.52 107.75 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -59.13 137.66 80.58 Favored 'Trans proline' 0 C--O 1.241 0.648 0 C-N-CA 122.006 1.804 . . . . 64.51 110.611 176.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -58.32 111.95 1.02 Allowed 'Trans proline' 0 C--O 1.248 1.01 0 C-N-CA 122.444 2.096 . . . . 73.11 111.96 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.7 m -67.71 105.37 1.89 Allowed 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.763 -0.653 . . . . 73.24 109.341 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -124.99 160.3 29.29 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.17 -0.678 . . . . 72.22 109.17 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 12.9 t -117.45 165.47 12.77 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 N-CA-C 107.692 -1.225 . . . . 75.13 107.692 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.539 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 63.7 mtm180 -85.12 66.96 10.01 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.822 0.82 . . . . 71.32 110.735 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -106.41 7.64 31.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.031 -0.986 . . . . 71.13 111.179 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.476 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 18.4 m -106.24 137.08 44.83 Favored 'General case' 0 N--CA 1.416 -2.142 0 C-N-CA 119.445 -0.902 . . . . 74.34 108.874 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -115.54 132.57 64.53 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.265 0 N-CA-C 107.557 -1.275 . . . . 55.22 107.557 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.29 125.56 50.65 Favored 'General case' 0 C--N 1.274 -2.716 0 N-CA-C 108.213 -1.032 . . . . 74.54 108.213 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 17.7 mt -105.33 143.65 33.21 Favored 'General case' 0 C--N 1.275 -2.646 0 N-CA-C 105.913 -1.884 . . . . 75.51 105.913 178.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . 0.401 ' HD3' ' OE1' ' A' ' 519' ' ' GLU . 49.2 ttt180 -152.62 141.28 20.9 Favored 'General case' 0 C--N 1.289 -2.023 0 C-N-CA 120.907 -0.317 . . . . 74.12 110.16 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 85.05 23.6 48.24 Favored Glycine 0 C--N 1.311 -0.827 0 N-CA-C 110.615 -0.994 . . . . 71.14 110.615 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.08 151.07 67.8 Favored Pre-proline 0 C--O 1.244 0.776 0 C-N-CA 123.974 0.91 . . . . 72.31 112.998 -176.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -61.45 151.91 76.53 Favored 'Trans proline' 0 N--CA 1.442 -1.509 0 C-N-CA 122.853 2.369 . . . . 72.22 110.642 173.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -77.68 92.23 4.11 Favored 'General case' 0 C--N 1.275 -2.634 0 CA-C-N 114.817 -1.083 . . . . 73.4 110.035 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.22 36.07 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.022 0 CA-C-N 112.226 -2.261 . . . . 43.41 112.456 174.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.66 124.49 19.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 107.717 -1.216 . . . . 65.44 107.717 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 8.6 p -76.13 150.27 37.24 Favored 'General case' 0 N--CA 1.399 -3.012 0 N-CA-C 109.123 -0.695 . . . . 65.43 109.123 -175.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.276 2.4 pp -61.7 -30.73 48.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 114.277 1.214 . . . . 74.42 114.277 -173.133 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . 0.428 ' N ' HD11 ' A' ' 458' ' ' ILE . 0.0 OUTLIER -81.56 -22.27 37.91 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.542 -0.863 . . . . 72.41 110.04 -177.7 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 20.6 t70 -75.67 -40.23 56.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.162 -0.926 . . . . 75.0 109.177 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 13.7 tt -76.0 -32.28 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 115.214 -0.903 . . . . 71.21 110.263 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 84.4 mt -72.14 -29.42 64.03 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.348 -0.612 . . . . 75.13 109.348 176.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 25.8 t70 -63.16 -53.39 54.1 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-N 115.324 -0.853 . . . . 61.43 108.784 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.81 -42.04 64.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 114.539 -1.21 . . . . 73.23 111.435 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.94 -37.16 78.7 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.828 -0.624 . . . . 53.32 110.982 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 77.36 -140.56 24.68 Favored Glycine 0 N--CA 1.421 -2.32 0 C-N-CA 120.42 -0.895 . . . . 71.12 112.153 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -48.63 -32.08 7.69 Favored 'General case' 0 C--N 1.291 -1.971 0 C-N-CA 126.238 1.815 . . . . 64.33 113.137 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -66.61 -23.44 66.18 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.965 0.412 . . . . 74.42 111.393 -177.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.93 -15.48 60.69 Favored 'General case' 0 C--O 1.206 -1.201 0 CA-C-N 116.136 -0.484 . . . . 63.44 111.532 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.8 m -78.08 -16.83 57.67 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-O 121.389 0.614 . . . . 75.32 110.387 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . 0.416 ' OD1' ' HB3' ' A' ' 495' ' ' MET . 11.7 t70 -84.69 -11.9 54.94 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 116.274 -0.421 . . . . 73.43 111.431 -175.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.1 tt -52.39 145.78 2.53 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 124.194 0.998 . . . . 71.12 111.889 -176.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . 0.414 ' O ' HG12 ' A' ' 472' ' ' ILE . 84.8 mtt180 -75.46 158.06 33.16 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.066 -1.087 . . . . 73.25 108.066 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 7.7 t -57.82 110.45 0.91 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-O 121.416 0.627 . . . . 72.21 111.065 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 62.29 27.01 16.18 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.57 1.148 . . . . 75.4 111.088 -176.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.63 19.11 2.06 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 115.276 0.87 . . . . 54.3 115.276 -176.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.5 p -93.61 110.6 23.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-O 121.536 0.684 . . . . 72.41 109.714 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -108.85 94.91 5.3 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.571 -1.27 . . . . 74.14 107.571 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' MET . . . . . 0.533 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 53.6 ttm -87.67 139.31 30.66 Favored 'General case' 0 C--N 1.287 -2.133 0 C-N-CA 120.394 -0.522 . . . . 53.41 109.73 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 66.3 t -81.67 97.85 3.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 N-CA-C 108.826 -0.805 . . . . 74.14 108.826 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.4 mt -97.26 154.02 17.67 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.369 -1.287 . . . . 73.51 107.83 178.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -93.32 173.44 7.71 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.391 -1.707 . . . . 74.34 106.391 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -59.35 -27.51 66.0 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 119.279 0.945 . . . . 74.11 111.724 -176.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -70.37 -11.84 61.18 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.746 0.819 . . . . 75.22 111.155 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 82.5 29.03 37.39 Favored Glycine 0 N--CA 1.432 -1.6 0 CA-C-N 116.131 -0.486 . . . . 37.65 112.412 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -123.1 140.24 33.18 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 108.437 -0.949 . . . . 71.45 108.437 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . 0.533 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 29.7 Cg_endo -63.51 134.23 43.63 Favored 'Trans proline' 0 C--O 1.242 0.707 0 C-N-CA 122.906 2.404 . . . . 64.03 113.727 -177.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 17.7 m -76.31 -18.58 58.88 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.735 0.779 . . . . 64.24 109.796 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 106.7 15.85 15.75 Favored Glycine 0 CA--C 1.497 -1.084 0 N-CA-C 111.172 -0.771 . . . . 71.53 111.172 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -127.42 151.85 48.28 Favored 'General case' 0 C--O 1.256 1.433 0 N-CA-C 105.412 -2.07 . . . . 61.35 105.412 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -165.21 153.95 12.09 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 118.153 0.433 . . . . 51.52 110.062 -177.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -125.69 120.13 29.85 Favored 'General case' 0 C--N 1.288 -2.101 0 N-CA-C 108.669 -0.863 . . . . 75.11 108.669 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 56.7 mt -107.66 130.18 60.42 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.53 0 N-CA-C 107.059 -1.459 . . . . 74.34 107.059 176.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . 0.476 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 9.3 tt0 -104.5 116.98 33.04 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.155 0.503 . . . . 75.41 110.155 -177.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' MET . . . . . 0.416 ' HB3' ' OD1' ' A' ' 471' ' ' ASP . 0.3 OUTLIER -92.79 172.59 8.25 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.197 -0.91 . . . . 72.22 110.192 178.09 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -88.16 -35.28 17.49 Favored 'General case' 0 N--CA 1.394 -3.253 0 CA-C-N 116.21 -0.45 . . . . 72.21 110.472 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.4 m -116.25 141.12 48.56 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-O 121.526 0.679 . . . . 61.44 112.085 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -73.03 -16.12 61.5 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.202 -0.908 . . . . 70.44 110.969 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -62.03 -56.38 19.57 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.654 -0.703 . . . . 75.21 109.686 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.27 70.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.082 -0.963 . . . . 74.45 111.243 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.17 -42.76 83.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.11 -0.496 . . . . 72.22 110.71 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -66.69 -44.48 81.62 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.072 0.463 . . . . 73.44 110.287 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 38.5 tpp -71.14 -33.32 69.96 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.75 -0.659 . . . . 74.5 110.991 -175.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.36 -40.55 81.43 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 109.647 -0.501 . . . . 71.11 109.647 176.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -69.41 -30.19 68.09 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.962 -0.563 . . . . 62.02 111.537 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -76.34 -40.78 50.4 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 120.811 -0.356 . . . . 74.24 110.509 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -69.88 -43.3 72.1 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.278 0.561 . . . . 61.25 110.63 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 61.0 m -99.35 16.75 22.03 Favored 'General case' 0 N--CA 1.415 -2.201 0 N-CA-C 113.529 0.937 . . . . 44.05 113.529 -173.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 10.9 t-80 -66.68 91.76 0.2 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.303 -0.559 . . . . 75.01 110.158 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 99.4 mttt 67.93 35.74 3.69 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 125.037 1.335 . . . . 63.52 110.758 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -80.35 147.77 30.93 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.614 -1.175 . . . . 74.13 109.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . 0.485 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 13.8 m120 -74.72 120.3 20.08 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 115.724 -0.671 . . . . 74.25 110.311 178.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.1 ttt -102.15 93.16 5.08 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 106.088 -1.819 . . . . 74.14 106.088 175.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 67.71 -77.38 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 124.297 1.039 . . . . 73.14 111.185 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -125.38 -18.49 5.31 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-O 121.811 0.815 . . . . 74.42 110.713 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 22.7 tpt180 -90.79 160.86 15.56 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.253 -0.885 . . . . 75.42 109.956 -170.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -113.91 116.26 28.99 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.29 -1.744 . . . . 74.54 106.29 172.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 92.9 t -110.86 122.0 64.57 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.921 0 CA-C-N 116.33 -0.396 . . . . 63.42 109.946 -176.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . 0.401 ' OE1' ' HD3' ' A' ' 450' ' ' ARG . 41.7 tt0 -85.71 109.46 18.63 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 107.891 -1.151 . . . . 75.23 107.891 176.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.5 t -105.02 124.65 59.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.295 -1.372 . . . . 54.5 107.295 176.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -133.4 138.28 46.2 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.44 -0.948 . . . . 53.02 108.44 -173.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . 0.401 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 46.4 tt0 -83.16 153.25 24.88 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.626 -0.509 . . . . 73.41 109.626 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . 0.401 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 5.9 p -162.66 171.5 16.79 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 122.769 0.428 . . . . 74.42 110.004 -177.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.539 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 1.3 m -97.59 160.47 14.3 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.7 -0.682 . . . . 73.35 109.429 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.88 -21.71 61.38 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.629 -0.714 . . . . 71.42 111.535 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.39 -54.1 23.46 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 116.343 -0.39 . . . . 72.03 110.372 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -38.51 82.7 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 110.215 -0.291 . . . . 75.31 110.215 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -59.35 -44.77 92.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.857 -0.61 . . . . 72.41 110.445 177.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -69.32 -40.67 77.49 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.315 0.579 . . . . 71.53 109.567 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -59.62 -44.53 93.42 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.221 -0.899 . . . . 74.22 111.271 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.4 t -73.65 -34.6 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 120.38 -0.528 . . . . 61.04 110.377 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.99 -21.91 62.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 75.44 111.443 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 65.5 mtm -88.49 -0.49 57.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.187 0.518 . . . . 73.33 111.153 176.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 74.69 27.25 65.45 Favored Glycine 0 C--N 1.301 -1.391 0 CA-C-N 115.242 -0.89 . . . . 64.24 112.77 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -69.11 140.28 33.91 Favored Glycine 0 N--CA 1.416 -2.683 0 N-CA-C 111.685 -0.566 . . . . 72.41 111.685 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 28.5 m -151.89 129.61 11.59 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.387 -0.968 . . . . 61.13 108.387 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 91.1 mt -80.12 97.28 6.79 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.275 -1.009 . . . . 74.32 108.275 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -90.19 65.04 6.28 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-O 122.674 1.226 . . . . 71.12 112.682 -176.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -140.26 94.47 2.75 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 106.763 -1.569 . . . . 73.53 106.763 174.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -155.13 137.64 15.06 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.246 -0.888 . . . . 60.21 110.444 -175.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 . . . . . 0 C--N 1.299 -1.621 0 N-CA-C 107.993 -1.114 . . . . 73.31 107.993 179.391 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' MET . . . . . 0.435 ' SD ' HG23 ' A' ' 443' ' ' VAL . 19.9 ptp . . . . . 0 CA--C 1.515 -0.385 0 N-CA-C 108.717 -0.846 . . . . 54.21 108.717 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -82.31 167.93 15.24 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 121.83 1.686 . . . . 75.24 108.714 171.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.34 105.52 0.15 Allowed 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.685 2.257 . . . . 71.32 111.413 178.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.4 m -142.3 159.37 42.37 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 107.771 -1.196 . . . . 74.22 107.771 -175.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . 0.418 ' OD1' ' HB2' ' A' ' 524' ' ' SER . 49.3 t30 -82.71 111.94 19.11 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.467 -0.938 . . . . 72.52 108.467 175.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . 0.435 HG23 ' SD ' ' A' ' 438' ' ' MET . 47.5 t -108.85 144.54 17.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 N-CA-C 109.672 -0.492 . . . . 72.22 109.672 -176.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.513 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 19.8 ptt85 -92.35 65.72 4.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.168 0.985 . . . . 74.22 111.401 177.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 33.2 p30 -112.75 12.11 19.55 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.294 -0.866 . . . . 74.41 110.408 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 30.7 m -109.18 145.77 35.25 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 108.752 -0.833 . . . . 62.13 108.752 -177.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.72 140.07 49.99 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.111 0 N-CA-C 108.248 -1.019 . . . . 55.25 108.248 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -111.6 121.69 45.83 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.07 -1.085 . . . . 70.41 108.07 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.9 mt -103.41 132.18 49.88 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 106.488 -1.671 . . . . 75.43 106.488 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -126.86 136.61 52.58 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 118.419 0.554 . . . . 55.35 109.621 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 96.09 38.86 4.46 Favored Glycine 0 C--N 1.31 -0.885 0 C-N-CA 120.489 -0.862 . . . . 41.22 111.654 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.1 mt -83.54 144.33 45.78 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.991 -0.374 . . . . 70.44 109.991 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . 0.416 ' HB2' ' HB3' ' A' ' 456' ' ' ALA . 31.8 Cg_exo -50.15 143.96 24.0 Favored 'Trans proline' 0 C--O 1.253 1.266 0 C-N-CA 123.113 2.542 . . . . 62.53 111.065 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -70.88 92.6 0.92 Allowed 'General case' 0 N--CA 1.417 -2.081 0 CA-C-O 122.402 1.096 . . . . 74.14 111.469 -177.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.87 33.62 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 111.162 -2.744 . . . . 75.34 112.415 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . 0.416 ' HB3' ' HB2' ' A' ' 453' ' ' PRO . . . -56.01 138.42 49.16 Favored 'General case' 0 C--O 1.246 0.883 0 N-CA-C 109.44 -0.578 . . . . 54.13 109.44 171.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 28.4 p -78.06 160.22 28.23 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 116.42 -0.354 . . . . 74.31 111.02 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.464 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 65.4 mt -65.34 -31.93 56.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.262 0.554 . . . . 63.1 109.601 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -64.01 -40.2 95.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.052 0.453 . . . . 54.31 110.249 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -70.16 -37.83 75.29 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.428 -0.806 . . . . 73.11 110.161 -176.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.431 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.4 tt -74.59 -32.01 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.027 -0.533 . . . . 75.11 110.651 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -67.31 -35.38 79.32 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.451 0.643 . . . . 53.43 110.001 176.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -65.13 -49.02 71.51 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.621 -0.881 . . . . 64.35 108.621 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -53.73 -41.92 67.58 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 113.894 -1.503 . . . . 75.13 111.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.88 -36.68 84.72 Favored 'General case' 0 C--O 1.248 0.998 0 CA-C-N 116.129 -0.487 . . . . 74.43 111.718 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 84.11 -143.18 21.06 Favored Glycine 0 N--CA 1.422 -2.29 0 C-N-CA 120.099 -1.048 . . . . 61.21 111.706 -178.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -54.52 -34.27 61.43 Favored 'General case' 0 C--N 1.3 -1.561 0 C-N-CA 123.527 0.731 . . . . 65.22 111.066 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . 0.428 ' O ' ' HE1' ' A' ' 495' ' ' MET . 95.0 m-85 -61.3 -17.45 53.71 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.559 -0.746 . . . . 73.14 112.599 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . 0.473 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -68.25 -15.29 63.52 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 120.836 0.35 . . . . 65.24 111.397 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 17.3 m -84.77 -20.53 30.88 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-O 121.894 0.854 . . . . 73.21 109.194 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 496' ' ' LYS . 35.4 m-20 -107.43 15.52 24.8 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.362 -0.835 . . . . 70.04 112.365 -174.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . 0.473 HG22 ' O ' ' A' ' 469' ' ' ALA . 11.6 tt -82.55 151.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 106.316 -1.735 . . . . 65.0 106.316 170.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 20.8 mtm-85 -100.3 153.76 19.04 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 118.975 -1.09 . . . . 61.14 111.128 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 10.0 t -62.58 136.27 57.81 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.566 -0.901 . . . . 73.34 108.566 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 67.9 22.83 8.54 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 122.294 1.045 . . . . 72.22 109.376 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -88.08 -20.46 49.54 Favored Glycine 0 N--CA 1.423 -2.224 0 C-N-CA 120.701 -0.762 . . . . 62.52 112.853 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 47.8 t -89.66 115.19 28.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 117.011 0.406 . . . . 72.23 110.988 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -127.65 98.09 5.08 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.881 -0.785 . . . . 75.22 108.881 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 86.0 mtp -83.9 139.44 32.61 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.849 -0.426 . . . . 75.31 109.849 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 43.0 t -84.04 97.98 5.33 Favored 'Isoleucine or valine' 0 C--O 1.251 1.171 0 CA-C-O 121.553 0.692 . . . . 71.14 109.728 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 65.2 mt -86.14 155.95 20.55 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.885 -1.154 . . . . 71.52 107.885 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -96.26 -178.67 4.39 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.583 -1.636 . . . . 72.33 106.583 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 47.5 m-70 -65.62 -9.81 30.21 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 119.022 0.828 . . . . 74.35 112.235 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . 0.435 ' OE1' ' HD3' ' A' ' 486' ' ' ARG . 35.2 tt0 -81.38 -12.79 58.86 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 123.855 0.862 . . . . 53.44 108.877 176.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 75.33 29.19 60.49 Favored Glycine 0 CA--C 1.494 -1.242 0 CA-C-N 115.275 -0.875 . . . . 62.33 111.373 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . 0.435 ' HD3' ' OE1' ' A' ' 484' ' ' GLN . 62.1 mtp85 -133.16 147.96 67.29 Favored Pre-proline 0 C--N 1.308 -1.238 0 N-CA-C 107.945 -1.132 . . . . 64.35 107.945 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -54.93 134.47 63.57 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 123.734 2.956 . . . . 53.14 115.061 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.7 m -75.48 -33.98 60.86 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.176 -0.92 . . . . 75.24 108.884 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 137.16 -16.35 3.66 Favored Glycine 0 CA--C 1.493 -1.309 0 N-CA-C 110.806 -0.917 . . . . 54.21 110.806 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -116.4 158.7 23.09 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-O 121.021 0.439 . . . . 74.31 110.554 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.33 167.69 29.54 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.687 -0.688 . . . . 55.03 109.53 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . 0.478 ' HB3' ' HE3' ' A' ' 528' ' ' MET . 91.2 m-85 -120.08 145.2 47.1 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.064 -0.717 . . . . 72.34 109.064 176.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 46.5 mt -133.44 131.89 57.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 N-CA-C 107.665 -1.235 . . . . 74.24 107.665 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . 0.411 ' HB2' ' HE1' ' A' ' 528' ' ' MET . 59.7 tt0 -106.47 124.47 49.65 Favored 'General case' 0 C--N 1.284 -2.269 0 CA-C-O 121.477 0.655 . . . . 74.45 109.997 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' MET . . . . . 0.428 ' HE1' ' O ' ' A' ' 468' ' ' PHE . 96.3 mmm -98.08 170.05 9.18 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.79 -1.095 . . . . 72.11 110.994 -175.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 471' ' ' ASP . 84.3 tttt -65.3 -46.39 80.58 Favored 'General case' 0 C--N 1.28 -2.432 0 C-N-CA 125.894 1.678 . . . . 71.34 111.738 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.7 m -130.22 142.61 50.55 Favored 'General case' 0 N--CA 1.408 -2.545 0 N-CA-C 108.617 -0.883 . . . . 70.31 108.617 -172.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.83 74.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.97 0.89 . . . . 75.12 111.126 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.84 -46.1 66.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 114.294 -1.321 . . . . 74.24 110.17 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -62.28 -38.26 88.66 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.821 -1.081 . . . . 72.21 110.293 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.34 -37.93 88.59 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.393 -0.821 . . . . 74.23 111.204 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.71 -41.46 83.51 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 110.045 -0.354 . . . . 61.22 110.045 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 54.8 ttm -67.81 -38.93 83.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.301 -0.408 . . . . 62.2 110.224 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.23 86.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.97 -0.559 . . . . 64.43 110.354 177.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.03 84.32 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.979 -0.555 . . . . 63.41 110.894 177.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -64.83 -42.09 95.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.702 -0.481 . . . . 74.12 109.702 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.05 -45.29 94.2 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.411 0.624 . . . . 65.51 111.105 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.7 m -94.45 6.75 47.81 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 112.848 0.684 . . . . 61.12 112.848 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -76.05 108.35 8.9 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.342 -0.849 . . . . 72.42 108.792 175.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 44.0 mttp 72.8 17.32 4.39 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.233 1.013 . . . . 64.35 112.066 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.17 138.27 36.84 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 115.894 -0.593 . . . . 73.34 109.801 -178.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -76.11 136.08 39.85 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 115.038 -0.983 . . . . 63.34 111.994 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.4 ttt -129.8 103.25 6.7 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 105.519 -2.03 . . . . 73.25 105.519 175.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 71.3 -78.89 0.04 OUTLIER 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.708 1.203 . . . . 63.21 110.698 -175.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -138.63 -14.79 1.23 Allowed 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.579 0.704 . . . . 64.01 111.843 176.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -92.23 156.46 17.28 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.891 -1.151 . . . . 75.51 107.891 -175.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -109.66 118.84 37.62 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-O 121.492 0.663 . . . . 73.02 109.321 173.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.9 t -92.35 131.23 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.262 0 N-CA-C 107.855 -1.165 . . . . 73.32 107.855 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -104.94 113.6 27.3 Favored 'General case' 0 N--CA 1.413 -2.31 0 N-CA-C 108.997 -0.742 . . . . 72.22 108.997 175.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 76.0 t -104.08 129.77 55.78 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.606 -1.179 . . . . 71.42 111.196 -177.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -127.57 141.94 51.5 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.281 -0.872 . . . . 73.44 109.076 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -84.0 151.92 24.73 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 117.958 0.345 . . . . 73.22 111.509 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.4 p -155.31 173.23 16.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 123.621 0.768 . . . . 62.53 109.746 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.5 p -102.13 159.59 15.25 Favored 'General case' 0 C--N 1.284 -2.266 0 N-CA-C 112.705 0.631 . . . . 71.41 112.705 -179.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.34 -37.62 67.69 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 123.871 0.869 . . . . 75.21 112.086 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.94 -35.64 81.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.997 -0.547 . . . . 75.15 110.713 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.73 -39.77 84.25 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 123.345 0.403 . . . . 61.11 110.568 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' MET . . . . . 0.534 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 42.6 ttm -59.58 -48.45 81.6 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.181 -0.674 . . . . 55.4 109.181 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.38 -35.49 80.56 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.069 -0.969 . . . . 74.44 110.203 -179.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -65.76 -42.3 91.02 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.657 -0.701 . . . . 73.23 110.153 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 88.1 t -72.58 -34.14 46.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 120.932 0.396 . . . . 71.24 110.5 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.9 mt -67.5 -35.51 79.29 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.187 0.518 . . . . 71.24 110.061 176.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 26.3 ttt -73.16 -18.44 61.27 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 122.104 0.954 . . . . 74.33 111.023 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 83.34 22.75 56.15 Favored Glycine 0 C--N 1.273 -2.968 0 CA-C-N 114.16 -1.382 . . . . 62.02 111.963 -177.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -64.69 136.07 38.6 Favored Glycine 0 N--CA 1.413 -2.874 0 N-CA-C 110.654 -0.978 . . . . 43.14 110.654 178.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 8.6 m -77.54 118.05 19.58 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-O 121.352 0.596 . . . . 75.42 110.361 -176.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 63.1 tp -111.59 94.36 4.92 Favored 'General case' 0 C--N 1.282 -2.359 0 N-CA-C 106.7 -1.593 . . . . 72.31 106.7 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -131.11 174.24 10.22 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 109.032 -0.729 . . . . 50.52 109.032 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 64.83 57.87 1.0 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 125.188 1.395 . . . . 72.34 109.611 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 91.0 mt -119.17 112.73 19.87 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.144 -0.935 . . . . 74.22 109.29 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 . . . . . 0 C--N 1.3 -1.583 0 N-CA-C 109.466 -0.568 . . . . 75.44 109.466 -178.704 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.496 -1.101 0 N-CA-C 108.58 -0.896 . . . . 65.5 108.58 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -70.54 150.36 63.35 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 121.529 1.486 . . . . 72.14 110.192 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.85 -17.13 29.24 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 121.791 1.66 . . . . 75.12 110.632 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 27.4 m -115.7 105.37 12.66 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 114.945 -1.025 . . . . 52.44 108.843 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -110.27 141.2 43.57 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 109.27 -0.641 . . . . 72.21 109.27 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -98.54 163.58 2.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 N-CA-C 108.536 -0.913 . . . . 62.41 108.536 -175.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.527 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 26.7 mtp180 -90.82 73.8 6.57 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-O 121.846 0.832 . . . . 75.43 109.72 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 26.4 p-10 -114.68 14.06 17.48 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 115.011 -0.995 . . . . 71.25 109.87 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 25.4 m -116.3 149.66 38.91 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 107.628 -1.249 . . . . 75.33 107.628 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -124.34 139.33 50.98 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.449 0 N-CA-C 108.935 -0.765 . . . . 74.22 108.935 -177.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -109.97 123.49 49.75 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.083 -1.081 . . . . 64.21 108.083 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 18.2 mt -99.83 144.36 28.98 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 106.979 -1.489 . . . . 73.24 106.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -141.28 140.0 33.79 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.545 -0.909 . . . . 72.34 108.545 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 84.06 32.03 24.46 Favored Glycine 0 C--N 1.291 -1.948 0 C-N-CA 120.315 -0.945 . . . . 74.53 111.727 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.1 138.35 89.75 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 115.981 -0.109 . . . . 74.01 110.852 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -58.25 144.97 94.95 Favored 'Trans proline' 0 CA--C 1.486 -1.914 0 C-N-CA 122.549 2.166 . . . . 73.52 111.31 176.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -78.14 106.69 10.19 Favored 'General case' 1 N--CA 1.376 -4.144 0 N-CA-C 106.908 -1.516 . . . . 73.32 106.908 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.97 29.61 0.02 OUTLIER 'General case' 0 C--N 1.267 -2.986 0 CA-C-N 111.91 -2.404 . . . . 62.15 112.841 173.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -87.3 120.03 28.17 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.317 -1.364 . . . . 64.11 107.317 169.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' THR . . . . . 0.574 ' HB ' ' OE1' ' A' ' 459' ' ' GLU . 20.1 p -74.39 157.24 36.02 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.389 0.138 . . . . 64.53 110.917 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.437 ' HA ' HG21 ' A' ' 461' ' ' ILE . 2.7 pp -65.34 -25.0 36.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 CA-C-O 121.19 0.519 . . . . 73.12 112.093 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . 0.574 ' OE1' ' HB ' ' A' ' 457' ' ' THR . 6.3 mp0 -68.21 -33.75 74.98 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.01 -0.737 . . . . 54.44 109.01 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -77.18 -34.1 56.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.21 -0.905 . . . . 64.04 109.646 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 465' ' ' LEU . 13.4 tt -78.74 -32.2 15.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.983 0 C-N-CA 120.092 -0.643 . . . . 73.34 111.062 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.82 -30.82 71.1 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.939 -0.476 . . . . 72.22 110.866 175.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -63.79 -53.28 53.35 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.944 -1.132 . . . . 61.23 107.944 172.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . 0.406 ' HB3' ' O ' ' A' ' 461' ' ' ILE . 80.1 t80 -51.92 -41.97 62.41 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 113.297 -1.774 . . . . 72.1 111.727 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 91.3 mt -64.65 -37.3 87.12 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.725 -0.67 . . . . 75.12 111.565 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 90.4 -141.85 16.08 Favored Glycine 0 N--CA 1.419 -2.496 0 C-N-CA 120.255 -0.974 . . . . 41.51 112.253 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.56 -27.88 12.26 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 124.852 1.261 . . . . 62.32 112.186 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -64.63 -13.53 54.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.591 . . . . 72.42 112.418 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -67.36 -19.92 65.49 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.105 0.478 . . . . 72.02 111.176 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.2 m -101.71 0.46 36.04 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-O 121.968 0.89 . . . . 64.32 109.811 176.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . 0.414 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 58.6 m-20 -108.56 6.14 25.72 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 121.816 -0.552 . . . . 63.1 112.333 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 7.6 tt -88.74 151.71 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.791 0 N-CA-C 107.61 -1.256 . . . . 43.31 107.61 174.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 42.5 ptt85 -78.02 161.88 27.15 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 118.48 -1.288 . . . . 63.3 109.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 32.7 m -66.69 115.87 6.99 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 115.589 -0.732 . . . . 74.31 110.483 -175.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 65.44 28.81 11.55 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.616 1.166 . . . . 74.32 109.741 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -80.0 8.22 52.01 Favored Glycine 0 N--CA 1.442 -0.902 0 CA-C-N 115.448 -0.796 . . . . 62.33 114.392 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.96 118.85 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.812 -0.811 . . . . 62.34 108.812 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -117.18 135.35 53.84 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 107.34 -1.356 . . . . 65.2 107.34 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 52.7 tpp -116.05 138.52 51.15 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 108.861 -0.792 . . . . 62.22 108.861 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.05 106.01 16.03 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.128 0 N-CA-C 108.327 -0.99 . . . . 43.45 108.327 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 60.1 mt -89.8 147.39 23.83 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 106.344 -1.725 . . . . 73.33 106.344 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -90.33 -169.38 2.39 Favored 'General case' 0 C--N 1.27 -2.882 0 CA-C-N 115.919 -0.582 . . . . 51.3 109.915 -176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -62.64 -29.06 70.34 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.526 0.679 . . . . 71.14 110.362 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -79.99 -7.0 58.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.542 -0.753 . . . . 74.31 110.55 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . 0.446 ' C ' ' HD2' ' A' ' 486' ' ' ARG . . . 79.36 21.88 66.22 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 116.263 -0.426 . . . . 71.03 113.075 176.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . 0.446 ' HD2' ' C ' ' A' ' 485' ' ' GLY . 8.5 mpt_? -120.31 151.32 53.29 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 108.667 -0.864 . . . . 73.33 108.667 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.15 123.38 13.7 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.467 2.112 . . . . 72.31 112.574 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 13.0 m -74.92 -8.35 56.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.689 -0.687 . . . . 71.33 111.004 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 87.74 16.43 59.92 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.368 -1.093 . . . . 42.41 110.368 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -125.56 132.78 52.5 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 103.968 -2.605 . . . . 54.22 103.968 -178.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -148.56 167.08 26.34 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 118.381 0.537 . . . . 53.5 110.42 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 85.4 m-85 -135.48 120.59 18.82 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 123.231 0.612 . . . . 74.33 109.606 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.4 mt -110.54 131.96 60.23 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 108.054 -1.091 . . . . 71.14 108.054 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -103.91 124.78 49.59 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 108.568 -0.901 . . . . 71.13 108.568 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 91.1 mmm -98.7 175.05 6.12 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.272 0.558 . . . . 73.25 111.304 -174.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -71.8 -34.77 69.66 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 124.933 1.293 . . . . 60.42 110.55 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 30.6 t -152.18 153.59 34.14 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 115.007 -0.997 . . . . 75.25 109.962 -172.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.2 75.36 Favored 'General case' 0 CA--C 1.508 -0.673 0 C-N-CA 123.814 0.846 . . . . 71.43 110.815 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -59.09 -48.23 82.37 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 122.488 1.137 . . . . 64.22 109.959 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . 0.414 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 1.5 mmp_? -65.7 -40.98 92.86 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 113.227 -1.806 . . . . 74.34 109.832 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.97 -40.99 87.59 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.281 -0.872 . . . . 73.32 110.581 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -66.12 -38.35 87.97 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.647 -0.706 . . . . 74.34 110.93 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 83.8 mtp -75.63 -36.31 60.24 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 119.482 -0.887 . . . . 64.02 110.965 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.22 -41.1 90.56 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.283 -0.417 . . . . 75.22 110.596 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.76 -36.18 80.06 Favored 'General case' 0 C--O 1.203 -1.371 0 CA-C-N 116.067 -0.515 . . . . 55.24 110.38 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -44.72 82.06 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.477 -0.329 . . . . 75.14 110.898 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -63.45 -43.55 97.07 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.668 0.605 . . . . 73.21 111.369 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.8 m -101.67 10.99 39.6 Favored 'General case' 0 N--CA 1.432 -1.354 0 N-CA-C 112.726 0.639 . . . . 54.05 112.726 -173.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . 0.455 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 44.0 t60 -70.4 97.56 1.29 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 119.853 -0.739 . . . . 75.33 109.206 176.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 66.4 66.24 0.47 Allowed 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 125.156 1.383 . . . . 74.12 110.203 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.3 tptt -112.79 140.81 47.26 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.323 -1.762 . . . . 72.43 108.818 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -86.32 132.46 33.97 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 120.211 -0.596 . . . . 72.41 110.596 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.3 ttt -118.26 88.66 2.96 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 106.13 -1.804 . . . . 72.21 106.13 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt 68.99 -83.52 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.059 -1.428 . . . . 74.01 113.01 -176.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -121.87 -9.77 8.76 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.393 0.616 . . . . 73.11 110.833 -173.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -115.24 156.65 24.99 Favored 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 108.518 -0.919 . . . . 71.45 108.518 -173.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -108.85 121.45 45.11 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 121.112 0.482 . . . . 73.13 109.787 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 60.5 t -102.9 114.04 41.34 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.951 0 CA-C-N 114.53 -1.214 . . . . 74.43 108.153 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -104.51 110.37 22.62 Favored 'General case' 0 C--N 1.279 -2.497 0 N-CA-C 107.625 -1.25 . . . . 65.42 107.625 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 73.5 t -104.82 129.02 58.04 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 CA-C-N 115.709 -0.678 . . . . 63.42 111.336 -175.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -116.06 152.11 34.23 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.325 -0.991 . . . . 75.32 108.325 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -90.99 157.81 17.07 Favored 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 106.835 -1.542 . . . . 74.13 106.835 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -157.69 160.51 38.03 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.405 0.622 . . . . 71.42 112.422 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 38.1 t -86.09 150.83 24.16 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.727 -1.124 . . . . 71.4 109.037 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.01 -30.03 67.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.208 0.528 . . . . 72.44 110.189 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -65.85 -51.47 58.6 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.56 1.144 . . . . 75.13 109.572 176.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -64.81 -37.48 87.76 Favored 'General case' 0 C--N 1.297 -1.69 0 C-N-CA 126.067 1.747 . . . . 73.01 109.798 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' MET . . . . . 0.432 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.2 ttt -67.03 -44.63 79.76 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.315 -0.857 . . . . 70.41 109.566 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -65.57 -38.11 88.6 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.874 -0.603 . . . . 61.43 109.779 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -59.31 -45.88 90.1 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.43 -0.805 . . . . 74.3 110.742 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 60.4 t -68.89 -39.65 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 120.18 -0.608 . . . . 74.51 110.326 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.5 mt -64.91 -28.67 69.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.489 . . . . 71.14 112.22 -178.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 24.3 mmt -83.86 15.78 3.14 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.049 0.388 . . . . 72.34 112.049 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 90.28 45.31 4.43 Favored Glycine 0 N--CA 1.428 -1.886 0 N-CA-C 110.935 -0.866 . . . . 39.0 110.935 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -66.51 130.67 31.75 Favored Glycine 0 N--CA 1.409 -3.108 0 CA-C-N 115.091 -0.554 . . . . 73.23 112.806 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 9.5 t -67.65 140.94 56.85 Favored 'General case' 0 N--CA 1.426 -1.647 0 N-CA-C 108.422 -0.955 . . . . 74.42 108.422 177.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 34.0 tp -116.66 76.4 1.03 Allowed 'General case' 0 C--N 1.292 -1.922 0 CA-C-O 121.986 0.898 . . . . 72.43 109.536 -178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -100.6 102.67 13.87 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 105.749 -1.945 . . . . 70.53 105.749 178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . 0.425 ' HD3' ' OE1' ' A' ' 541' ' ' GLU . 19.0 ptp180 -68.1 154.42 41.7 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 115.731 -0.668 . . . . 73.03 110.506 -176.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.1 tt -151.66 100.07 2.66 Favored 'General case' 0 N--CA 1.409 -2.502 0 N-CA-C 104.026 -2.583 . . . . 62.35 104.026 173.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . 0.425 ' OE1' ' HD3' ' A' ' 539' ' ' ARG . 13.7 pt-20 . . . . . 0 C--N 1.289 -2.025 0 CA-C-N 115.582 -0.735 . . . . 74.32 109.706 -177.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 CA--C 1.51 -0.593 0 N-CA-C 110.179 -0.304 . . . . 72.02 110.179 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.93 156.56 48.41 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.047 1.831 . . . . 75.33 110.124 173.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -53.82 160.51 5.65 Favored 'Trans proline' 0 C--O 1.255 1.35 0 C-N-CA 123.66 2.907 . . . . 72.53 113.506 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 18.7 m 67.55 77.07 0.27 Allowed 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.788 -1.096 . . . . 64.01 109.03 -175.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -82.97 119.46 24.47 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 114.718 -1.128 . . . . 72.15 109.553 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 36.6 t -92.8 161.01 2.62 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.741 0 N-CA-C 107.712 -1.218 . . . . 63.45 107.712 -178.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.497 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.6 mtm180 -88.1 75.76 8.63 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 108.507 -0.923 . . . . 72.44 108.507 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -116.18 11.17 15.12 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.173 -1.376 . . . . 75.4 112.196 -171.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.413 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 56.6 m -106.63 152.43 23.76 Favored 'General case' 0 N--CA 1.407 -2.575 0 C-N-CA 119.547 -0.861 . . . . 65.43 109.464 -176.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -122.26 140.13 47.09 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.109 0 N-CA-C 106.495 -1.669 . . . . 75.35 106.495 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . 0.534 ' HD3' ' NH2' ' A' ' 450' ' ' ARG . 20.1 ttm180 -115.4 125.45 53.17 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.052 -0.722 . . . . 61.41 109.052 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 8.7 mt -107.12 145.66 32.22 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 107.647 -1.242 . . . . 62.21 107.647 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . 0.534 ' NH2' ' HD3' ' A' ' 448' ' ' ARG . 2.7 ptp180 -149.31 130.81 14.82 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 121.08 0.467 . . . . 75.25 111.706 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 111.02 29.95 3.35 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.407 -0.815 . . . . 38.31 111.094 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 91.4 mt -70.6 133.12 86.93 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 111.665 0.246 . . . . 75.41 111.665 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . 0.493 ' HA ' ' CZ ' ' A' ' 516' ' ' ARG . 31.3 Cg_exo -58.58 164.64 9.0 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 123.305 2.67 . . . . 72.35 113.389 175.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -77.47 100.15 5.91 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.964 -1.471 . . . . 73.02 108.179 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.61 32.62 0.02 OUTLIER 'General case' 0 C--N 1.277 -2.544 0 CA-C-N 111.756 -2.475 . . . . 73.12 111.421 173.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.85 113.62 3.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.024 -1.102 . . . . 73.41 108.024 171.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 72.8 p -84.26 170.47 13.67 Favored 'General case' 0 N--CA 1.426 -1.642 0 CA-C-O 120.98 0.419 . . . . 62.33 112.048 -173.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.578 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 35.9 pt -63.68 -24.85 36.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.689 -0.687 . . . . 70.25 110.255 174.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.86 -43.04 37.66 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.254 -0.647 . . . . 74.43 109.254 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 7.9 t70 -69.64 -32.29 70.88 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.286 -0.87 . . . . 74.13 109.845 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.415 HG23 ' O ' ' A' ' 458' ' ' ILE . 11.7 tt -74.53 -29.02 23.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 C-N-CA 120.293 -0.563 . . . . 73.21 110.288 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 85.6 mt -65.45 -36.06 82.76 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.564 -0.532 . . . . 70.4 109.564 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . 0.528 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 22.6 t70 -57.38 -56.23 24.48 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.371 -0.831 . . . . 71.13 109.074 171.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -53.3 -40.47 64.77 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 113.506 -1.679 . . . . 71.25 111.82 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 82.3 mt -73.26 -37.29 66.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.654 -0.703 . . . . 64.55 112.357 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.49 -137.16 39.62 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 119.762 -1.209 . . . . 72.54 112.09 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -57.43 -21.89 39.69 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 124.632 1.173 . . . . 73.43 112.354 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -69.39 -10.14 56.62 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.372 0.508 . . . . 71.22 112.372 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -65.98 -15.22 62.81 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.353 0.597 . . . . 73.23 110.933 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 13.9 m -87.54 -14.87 39.07 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-O 121.115 0.483 . . . . 64.21 111.014 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.2 6.69 20.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.64 0.978 . . . . 64.44 113.64 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 8.9 tt -90.58 151.47 3.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 N-CA-C 108.524 -0.917 . . . . 74.33 108.524 175.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -78.78 148.18 33.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.093 -0.706 . . . . 73.33 109.093 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 29.1 m -51.43 109.97 0.4 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.359 1.064 . . . . 64.34 112.777 -175.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 34.6 m170 64.13 28.68 14.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.509 1.124 . . . . 73.42 110.707 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.42 20.58 8.57 Favored Glycine 0 N--CA 1.43 -1.74 0 CA-C-N 114.986 -1.006 . . . . 42.2 113.453 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.83 106.15 17.57 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 N-CA-C 106.67 -1.604 . . . . 64.42 106.67 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -114.35 93.27 4.27 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 109.153 -0.684 . . . . 74.44 109.153 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -83.82 142.68 30.46 Favored 'General case' 0 C--N 1.294 -1.844 0 C-N-CA 120.564 -0.455 . . . . 64.33 109.935 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 57.3 t -76.74 124.92 35.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 106.581 -1.637 . . . . 74.1 106.581 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.23 154.95 18.55 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.16 0.505 . . . . 70.33 109.996 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -96.04 172.02 8.26 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 105.775 -1.935 . . . . 71.33 105.775 176.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -65.51 -5.18 7.22 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.693 0.997 . . . . 65.53 113.693 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . 0.462 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 36.2 tt0 -92.56 -1.11 57.17 Favored 'General case' 0 CA--C 1.555 1.17 0 CA-C-O 121.984 0.897 . . . . 70.23 109.25 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.19 30.65 62.56 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.629 -0.714 . . . . 65.14 112.83 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . 0.462 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 93.9 mtt180 -127.81 148.6 67.7 Favored Pre-proline 0 C--N 1.306 -1.287 0 N-CA-C 107.905 -1.146 . . . . 73.34 107.905 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.92 133.45 54.82 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.08 2.52 . . . . 54.42 113.531 -177.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.9 m -73.73 -17.91 61.06 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 123.888 0.875 . . . . 73.1 111.165 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 118.02 -20.14 10.79 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 110.444 -1.062 . . . . 64.12 110.444 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -108.33 148.52 29.94 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 106.543 -1.651 . . . . 70.01 106.543 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -159.71 171.13 20.1 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 117.903 0.32 . . . . 55.04 110.803 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . 0.451 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 98.3 m-85 -128.55 151.08 49.85 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.605 -0.725 . . . . 64.04 109.511 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 50.7 mt -131.14 137.41 55.78 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.737 0 N-CA-C 105.849 -1.908 . . . . 62.55 105.849 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -110.72 115.89 30.35 Favored 'General case' 0 C--N 1.276 -2.622 0 C-N-CA 119.197 -1.001 . . . . 74.24 109.223 177.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 3.2 tpt -92.73 167.09 12.11 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.718 -1.128 . . . . 64.34 108.996 -172.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -53.24 -45.45 68.75 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.95 1.3 . . . . 75.21 112.295 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 22.6 m -147.65 168.4 22.14 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.282 -0.872 . . . . 73.52 110.0 -173.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.47 93.86 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 123.863 0.727 . . . . 73.53 111.911 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -69.2 -37.69 78.22 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 108.912 -0.773 . . . . 73.43 108.912 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -47.75 83.45 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.228 -1.351 . . . . 71.4 110.2 175.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -64.02 -39.06 93.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 65.11 110.495 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.75 -44.87 95.07 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.653 -0.703 . . . . 74.21 110.878 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 26.4 ttt -69.0 -37.23 78.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.146 -0.479 . . . . 73.23 110.18 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.99 83.17 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.81 -0.632 . . . . 65.41 110.515 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.85 -38.96 87.38 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.191 -0.458 . . . . 72.2 110.65 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -66.91 -41.4 87.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.12 0.486 . . . . 51.33 109.987 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -64.34 -40.26 95.53 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.578 -0.737 . . . . 72.24 111.36 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 22.9 m -107.86 13.77 26.02 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 113.252 0.834 . . . . 71.23 113.252 -173.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -67.89 98.29 0.73 Allowed 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.884 -0.51 . . . . 74.04 109.714 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 85.8 tttt 66.09 54.5 0.98 Allowed 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.95 1.3 . . . . 72.43 109.604 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -93.26 140.35 29.63 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.701 -1.59 . . . . 60.12 109.023 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -84.7 113.7 21.49 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-O 121.077 0.465 . . . . 75.31 109.815 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 23.9 ttt -94.41 93.3 7.59 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 105.345 -2.094 . . . . 61.44 105.345 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 13.3 mptt 68.1 -82.26 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.871 -1.059 . . . . 72.05 111.333 -173.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -131.77 0.45 3.93 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 112.077 0.399 . . . . 71.42 112.077 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . 0.493 ' CZ ' ' HA ' ' A' ' 453' ' ' PRO . 15.8 ttm180 -118.49 146.54 44.44 Favored 'General case' 0 C--N 1.298 -1.671 0 C-N-CA 119.848 -0.741 . . . . 63.03 109.166 -176.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -89.59 120.76 31.17 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 109.111 -0.7 . . . . 74.33 109.111 -177.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 71.2 t -107.39 115.11 47.95 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.825 0 N-CA-C 107.246 -1.391 . . . . 75.4 107.246 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -94.19 112.75 24.59 Favored 'General case' 0 C--N 1.285 -2.21 0 N-CA-C 108.287 -1.005 . . . . 74.21 108.287 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -105.2 128.7 58.89 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.084 0 CA-C-N 115.439 -0.801 . . . . 63.42 110.373 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -128.83 159.55 35.39 Favored 'General case' 0 C--O 1.211 -0.924 0 C-N-CA 123.309 0.643 . . . . 71.34 109.302 -178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.22 143.92 25.79 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.401 -0.592 . . . . 72.4 109.401 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 7.3 p -141.6 171.1 14.52 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 122.872 0.469 . . . . 61.45 111.4 -177.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.9 m -98.64 144.89 27.43 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 115.698 -0.683 . . . . 74.44 111.261 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . 0.413 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -62.84 -31.91 73.02 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.817 0.673 . . . . 75.44 112.817 -177.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.69 -41.12 92.79 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.943 0.402 . . . . 74.14 110.469 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -72.2 -39.03 68.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.394 0.616 . . . . 71.44 109.358 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -62.66 -44.04 97.28 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.1 -0.954 . . . . 73.43 109.71 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.48 -30.29 68.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.198 0.523 . . . . 64.52 110.411 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -65.71 -45.2 83.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.616 -0.72 . . . . 72.42 109.575 178.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 58.3 t -67.02 -38.62 81.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.98 -0.555 . . . . 63.22 110.08 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 65.5 mt -67.15 -25.07 65.98 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.013 0.435 . . . . 75.3 111.487 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 27.1 ttt -87.32 -0.32 56.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.712 0.768 . . . . 71.34 110.691 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 65.39 37.83 94.27 Favored Glycine 0 C--N 1.305 -1.17 0 CA-C-N 114.975 -1.011 . . . . 55.33 111.425 -177.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -64.92 136.14 37.96 Favored Glycine 0 N--CA 1.413 -2.882 0 CA-C-N 115.196 -0.502 . . . . 63.21 113.525 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 25.6 m -96.61 131.12 43.58 Favored 'General case' 0 N--CA 1.418 -2.038 0 N-CA-C 108.211 -1.033 . . . . 65.22 108.211 177.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -120.69 125.56 47.98 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.617 -1.253 . . . . 73.33 107.617 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -126.89 92.79 3.61 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.242 0.544 . . . . 71.24 111.782 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -92.3 101.46 13.95 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 105.402 -2.073 . . . . 72.45 105.402 169.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 540' ' ' LEU . 1.9 pt? -103.37 136.52 42.97 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 114.67 1.359 . . . . 74.44 114.67 -167.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 . . . . . 0 N--CA 1.418 -2.07 0 N-CA-C 105.517 -2.031 . . . . 73.22 105.517 175.626 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.714 0 N-CA-C 108.49 -0.929 . . . . 74.31 108.49 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -65.27 117.99 5.06 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.205 1.937 . . . . 73.34 110.47 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -69.26 -40.06 6.63 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.397 2.065 . . . . 75.14 111.451 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.8 m -107.69 127.5 53.73 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.61 -0.885 . . . . 74.32 108.61 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -97.24 92.97 6.26 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.603 0.716 . . . . 63.34 111.771 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . 0.465 ' HB ' ' OD2' ' A' ' 445' ' ' ASP . 25.5 t -116.9 166.35 11.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 N-CA-C 107.273 -1.38 . . . . 73.15 107.273 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.527 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.0 mtp85 -84.63 52.53 2.41 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 122.154 0.978 . . . . 75.32 109.731 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . 0.465 ' OD2' ' HB ' ' A' ' 443' ' ' VAL . 3.3 p30 -101.65 2.47 38.79 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.801 -1.091 . . . . 71.11 111.023 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 23.3 m -110.96 141.31 44.58 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 118.869 -1.132 . . . . 40.11 109.012 -174.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . 0.406 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.4 mt -120.62 144.17 30.32 Favored 'Isoleucine or valine' 0 C--N 1.26 -3.318 0 N-CA-C 107.704 -1.221 . . . . 70.21 107.704 -177.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . 0.539 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 28.0 ttp180 -119.67 124.97 47.57 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.333 0.587 . . . . 73.13 109.815 173.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 8.6 mt -93.75 133.54 37.02 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 105.907 -1.886 . . . . 75.33 105.907 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . 0.453 ' C ' ' HD3' ' A' ' 450' ' ' ARG . 2.0 tmt_? -128.17 130.96 48.87 Favored 'General case' 0 C--N 1.277 -2.586 0 CA-C-O 121.221 0.534 . . . . 74.01 109.667 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.426 ' O ' HG21 ' A' ' 518' ' ' VAL . . . 95.48 47.92 2.46 Favored Glycine 0 C--N 1.283 -2.365 0 N-CA-C 110.248 -1.141 . . . . 36.48 110.248 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 83.3 mt -72.63 148.69 90.34 Favored Pre-proline 0 C--N 1.312 -1.035 0 N-CA-C 111.763 0.282 . . . . 73.42 111.763 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.04 179.35 0.8 Allowed 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.701 2.267 . . . . 65.23 111.161 173.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -77.74 87.61 3.99 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 115.527 -0.761 . . . . 74.34 111.631 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 63.88 41.83 6.44 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 113.045 -1.889 . . . . 73.24 111.427 169.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -50.0 125.28 11.71 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 114.999 -1.0 . . . . 71.23 108.414 171.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 1.6 p -72.24 162.46 29.44 Favored 'General case' 0 N--CA 1.419 -1.99 0 N-CA-C 113.409 0.892 . . . . 73.12 113.409 -170.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.46 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.1 pt -60.25 -27.54 39.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 113.871 1.063 . . . . 73.34 113.871 -172.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.77 -26.68 34.25 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.129 -1.028 . . . . 74.11 110.38 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . 0.587 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 5.2 t70 -78.34 -28.48 47.24 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.019 -0.537 . . . . 75.14 110.462 -178.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 458' ' ' ILE . 15.4 tt -70.18 -32.04 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 C-N-CA 119.617 -0.833 . . . . 73.1 108.832 175.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 88.3 mt -70.71 -36.07 73.05 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.311 0.577 . . . . 72.32 109.507 176.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . 0.587 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 6.3 t70 -55.48 -55.96 25.8 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.746 -1.115 . . . . 73.45 108.825 173.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 113.749 -1.569 . . . . 75.15 111.598 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 57.9 mt -67.42 -29.96 69.59 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 113.062 0.764 . . . . 72.23 113.062 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.95 -137.92 26.15 Favored Glycine 0 N--CA 1.425 -2.066 0 C-N-CA 119.161 -1.495 . . . . 36.48 111.72 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -58.09 -28.12 64.3 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.699 -0.75 . . . . 63.22 112.372 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -70.67 -11.2 60.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.24 0.459 . . . . 72.25 112.24 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -64.44 -22.22 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.175 0.805 . . . . 71.4 113.175 -176.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 11.7 t -101.7 -3.15 28.71 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.618 0.723 . . . . 71.03 110.49 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.99 3.27 41.42 Favored 'General case' 0 C--O 1.245 0.841 0 CA-C-O 121.235 0.541 . . . . 72.5 111.319 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 10.4 tt -75.49 148.49 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.287 0 N-CA-C 107.627 -1.249 . . . . 75.23 107.627 173.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 62.2 mtm180 -79.38 164.85 23.7 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 120.113 -0.635 . . . . 75.41 110.967 176.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 8.8 m -52.87 107.12 0.2 Allowed 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.973 0.909 . . . . 71.44 112.128 -174.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 60.88 27.7 17.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.119 0.968 . . . . 70.42 111.629 177.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -72.85 -1.45 55.0 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.106 -0.952 . . . . 43.01 114.576 -176.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.8 p -86.42 115.26 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 CA-C-O 121.866 0.841 . . . . 64.41 109.622 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -124.64 96.77 5.02 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.851 -0.613 . . . . 74.24 109.85 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' MET . . . . . 0.46 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 62.0 mtt -77.75 133.97 38.16 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.477 -0.934 . . . . 73.35 108.477 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 58.5 t -78.12 101.57 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.314 0 N-CA-C 107.551 -1.277 . . . . 61.42 107.551 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 73.8 mt -93.35 156.67 16.65 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-N 115.495 -0.775 . . . . 45.11 110.309 -177.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -103.31 179.76 4.18 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 105.878 -1.897 . . . . 73.24 105.878 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -55.57 -38.72 69.73 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 124.054 0.941 . . . . 75.41 112.424 -174.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.93 -1.85 27.52 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.274 0.559 . . . . 74.14 111.941 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 78.69 31.95 42.99 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.783 -0.722 . . . . 45.12 111.898 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -118.01 139.78 27.02 Favored Pre-proline 0 C--N 1.307 -1.264 0 N-CA-C 107.577 -1.268 . . . . 74.05 107.577 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.47 134.17 49.96 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.051 1.834 . . . . 73.3 110.987 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.8 m -75.94 1.87 14.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.647 0.737 . . . . 65.22 110.929 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.71 -30.76 6.23 Favored Glycine 0 CA--C 1.49 -1.481 0 CA-C-N 115.452 -0.794 . . . . 73.31 112.145 175.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . 0.447 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.1 p-10 -113.45 149.9 33.56 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-O 121.184 0.516 . . . . 55.12 111.639 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . 0.46 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -150.75 155.56 39.52 Favored 'General case' 0 C--O 1.204 -1.31 0 CA-C-N 115.497 -0.774 . . . . 55.3 109.533 -177.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . 0.539 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 81.5 m-85 -111.28 146.09 37.62 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-O 121.189 0.519 . . . . 65.15 111.42 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 61.1 mt -126.51 122.13 60.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 106.52 -1.659 . . . . 75.43 106.52 172.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -100.96 114.08 27.65 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 115.633 -0.712 . . . . 73.05 109.907 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 94.9 mmm -92.88 172.94 8.01 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.4 0.619 . . . . 64.14 111.419 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -75.51 -40.47 57.03 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.045 -0.979 . . . . 74.1 110.192 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 41.5 t -140.98 150.81 43.56 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 116.268 -0.423 . . . . 73.4 110.289 -175.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.56 -29.79 70.45 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 123.969 0.908 . . . . 73.41 112.324 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -64.08 -42.84 96.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.868 0.842 . . . . 74.43 109.693 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -68.53 -38.73 81.09 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 114.534 -1.212 . . . . 74.14 110.463 177.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.35 90.81 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.891 -0.595 . . . . 53.02 110.975 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -68.78 -42.26 77.67 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.848 -0.427 . . . . 74.14 109.848 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 51.1 ttm -64.26 -40.91 96.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.987 -0.551 . . . . 74.41 110.486 -177.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.37 -39.95 81.61 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 116.226 -0.443 . . . . 54.13 110.188 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.89 -37.22 81.5 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 116.17 -0.468 . . . . 65.01 111.123 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -65.32 -44.58 87.39 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.944 -0.391 . . . . 54.54 109.944 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -66.09 -39.95 90.4 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.87 -0.605 . . . . 74.32 110.583 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 38.2 m -99.43 12.38 36.53 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 113.259 0.837 . . . . 74.32 113.259 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -70.23 95.69 1.03 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.365 -0.834 . . . . 63.31 109.891 176.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.1 tttt 64.33 62.65 0.81 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.977 1.711 . . . . 75.41 110.056 -177.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -108.14 148.56 29.68 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 112.641 -2.072 . . . . 73.42 108.803 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -77.12 119.87 21.42 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.176 0.512 . . . . 75.13 110.221 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.6 ttt -103.98 80.32 1.73 Allowed 'General case' 0 N--CA 1.404 -2.729 0 N-CA-C 105.584 -2.006 . . . . 61.23 105.584 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . 0.496 ' HD2' ' N ' ' A' ' 514' ' ' LYS . 0.1 OUTLIER 68.8 -75.75 0.06 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 113.601 -1.636 . . . . 72.34 112.204 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -106.09 -31.79 8.55 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 113.292 0.849 . . . . 54.55 113.292 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -110.61 157.79 19.3 Favored 'General case' 0 C--N 1.273 -2.719 0 CA-C-N 115.788 -0.642 . . . . 74.31 110.542 -168.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -95.32 126.89 40.94 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.467 -1.679 . . . . 54.51 106.467 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . 0.426 HG21 ' O ' ' A' ' 451' ' ' GLY . 66.7 t -114.06 120.28 63.42 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.678 0 N-CA-C 108.795 -0.817 . . . . 73.42 108.795 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.83 112.47 22.51 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 107.785 -1.191 . . . . 75.2 107.785 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -103.69 129.68 55.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 109.963 -0.384 . . . . 53.32 109.963 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.662 -0.699 . . . . 74.22 109.244 -177.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . 0.453 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 42.0 tt0 -87.63 155.64 19.85 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.038 -1.097 . . . . 63.35 108.038 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . 0.453 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 7.9 p -162.05 171.69 17.12 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.461 0.648 . . . . 74.11 110.942 -178.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 60.3 p -91.88 155.35 18.25 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.104 -0.953 . . . . 72.44 110.167 177.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.67 -27.82 52.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.316 -0.856 . . . . 72.2 111.433 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.32 -51.87 67.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 74.32 109.168 176.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.7 -37.42 87.27 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.338 -0.846 . . . . 74.23 109.883 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' MET . . . . . 0.449 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 24.8 ttt -61.56 -46.85 88.14 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.695 -0.684 . . . . 74.21 110.848 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -73.4 -28.97 62.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.925 -0.71 . . . . 73.32 109.639 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.33 -47.86 82.36 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 115.739 -0.664 . . . . 73.34 110.231 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.7 t -69.76 -34.54 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 120.826 -0.35 . . . . 75.14 110.276 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.3 mt -67.45 -30.78 70.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.903 0.382 . . . . 71.13 111.094 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 26.3 ttt -76.34 -12.13 60.02 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.131 0.967 . . . . 63.43 110.737 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 88.63 20.89 45.89 Favored Glycine 0 C--N 1.285 -2.288 0 CA-C-N 114.407 -1.27 . . . . 62.2 112.652 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . 77.35 -178.23 51.85 Favored Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 121.332 -0.461 . . . . 45.41 112.139 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 28.9 m -157.1 132.27 9.03 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.714 -1.217 . . . . 74.24 107.714 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 6.1 mp -93.53 89.12 6.15 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 107.477 -1.305 . . . . 60.12 107.477 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -101.62 82.36 2.28 Favored 'General case' 0 C--N 1.292 -1.932 0 CA-C-N 115.699 -0.682 . . . . 73.33 111.885 -173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -175.68 79.96 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.135 -0.939 . . . . 75.04 109.922 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.4 mp -111.42 81.34 1.43 Allowed 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.097 -1.446 . . . . 75.43 107.097 175.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 . . . . . 0 C--N 1.295 -1.791 0 N-CA-C 108.396 -0.964 . . . . 75.24 108.396 -175.357 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 65.0 mtt . . . . . 0 CA--C 1.504 -0.808 0 N-CA-C 109.258 -0.645 . . . . 75.42 109.258 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -72.19 120.98 7.14 Favored 'Trans proline' 0 C--O 1.247 0.954 0 C-N-CA 122.144 1.896 . . . . 75.04 110.542 176.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -58.28 107.64 0.34 Allowed 'Trans proline' 0 C--N 1.359 1.126 0 C-N-CA 122.037 1.825 . . . . 73.33 109.529 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 27.1 m -85.2 84.84 7.55 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-O 121.993 0.902 . . . . 73.0 111.889 -173.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -119.6 137.31 53.94 Favored 'General case' 0 C--N 1.291 -1.957 0 CA-C-N 114.796 -1.093 . . . . 60.04 108.45 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.44 140.52 19.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.421 0 O-C-N 124.292 0.995 . . . . 74.05 109.465 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.502 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 54.4 mtm180 -80.87 63.78 5.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.805 0.812 . . . . 74.34 109.758 176.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 40.7 p-10 -95.79 4.21 53.08 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 115.31 -0.859 . . . . 64.04 110.012 -175.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.589 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 39.3 m -102.7 149.43 24.45 Favored 'General case' 0 N--CA 1.411 -2.419 0 CA-C-O 121.616 0.722 . . . . 75.21 110.618 -174.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . 0.632 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.4 mt -125.46 145.4 32.89 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.738 0 CA-C-N 114.608 -1.178 . . . . 54.53 107.95 178.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -119.83 120.37 36.27 Favored 'General case' 0 N--CA 1.416 -2.161 0 N-CA-C 106.472 -1.677 . . . . 75.2 106.472 172.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 13.0 mt -103.93 131.5 51.1 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 106.741 -1.578 . . . . 75.24 106.741 -178.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -132.82 142.98 49.25 Favored 'General case' 0 C--N 1.257 -3.415 0 N-CA-C 108.497 -0.927 . . . . 71.12 108.497 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 96.4 26.24 11.27 Favored Glycine 0 C--N 1.289 -2.03 0 C-N-CA 120.052 -1.07 . . . . 63.34 110.765 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 64.3 mt -72.95 144.25 85.07 Favored Pre-proline 0 C--N 1.304 -1.376 0 N-CA-C 109.276 -0.638 . . . . 71.24 109.276 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -55.41 161.13 7.75 Favored 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.883 2.389 . . . . 70.51 112.001 175.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -77.35 90.63 3.79 Favored 'General case' 0 N--CA 1.411 -2.417 0 CA-C-N 115.067 -0.97 . . . . 72.04 111.04 -177.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.11 29.93 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 112.085 -2.325 . . . . 74.14 112.672 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.15 140.79 52.66 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.3 -1.37 . . . . 74.5 107.3 170.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 68.2 p -86.43 174.39 9.02 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 120.345 -0.542 . . . . 72.03 111.709 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.42 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 72.0 mt -63.97 -37.37 79.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 108.998 -0.742 . . . . 74.04 108.998 177.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.15 -37.6 87.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.86 -0.609 . . . . 73.21 109.811 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -65.75 -42.85 90.43 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.806 -0.634 . . . . 65.11 110.706 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.4 HG21 ' O ' ' A' ' 458' ' ' ILE . 9.3 tp -72.71 -33.39 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 119.98 -0.688 . . . . 71.2 110.681 -177.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -68.88 -32.86 72.83 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.156 0.503 . . . . 63.13 109.668 177.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.77 -52.71 59.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-N 115.127 -0.942 . . . . 51.55 108.766 176.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.26 -41.29 79.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.078 -1.419 . . . . 70.22 111.325 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 67.9 mt -67.78 -32.6 73.29 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.892 -0.594 . . . . 73.2 111.859 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.06 -124.09 7.61 Favored Glycine 0 N--CA 1.418 -2.537 0 C-N-CA 119.377 -1.392 . . . . 63.44 113.129 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -42.58 -42.21 3.31 Favored 'General case' 0 C--N 1.287 -2.146 0 C-N-CA 126.693 1.997 . . . . 72.53 112.625 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -66.16 -12.37 55.43 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.359 -0.837 . . . . 71.53 112.785 -172.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.35 -15.7 60.93 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.406 0.622 . . . . 71.12 110.352 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.5 m -85.23 -28.03 25.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.63 0.729 . . . . 53.23 110.238 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -106.75 15.68 25.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.906 0.86 . . . . 74.02 110.631 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -68.43 142.6 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 N-CA-C 108.856 -0.794 . . . . 71.31 108.856 176.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.15 143.36 33.93 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 106.142 -1.799 . . . . 70.32 106.142 178.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 22.3 m -54.8 106.86 0.24 Allowed 'General case' 0 C--N 1.298 -1.635 0 O-C-N 124.254 0.971 . . . . 75.11 111.944 -172.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 27.0 m170 60.72 35.03 19.79 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.026 0.93 . . . . 73.4 111.729 -177.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -83.41 -0.39 90.02 Favored Glycine 0 N--CA 1.432 -1.625 0 CA-C-N 115.004 -0.998 . . . . 65.12 111.422 175.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 5.5 p -82.06 127.86 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 CA-C-O 121.221 0.534 . . . . 73.4 110.05 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -138.77 96.83 3.2 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.054 -1.091 . . . . 73.14 108.054 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' MET . . . . . 0.493 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 55.4 ttm -78.24 139.75 38.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.366 -0.605 . . . . 74.5 109.366 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 74.7 t -94.29 110.61 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.726 0 CA-C-O 122.105 0.955 . . . . 73.21 111.136 -176.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -104.59 159.8 15.46 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.189 -1.368 . . . . 73.34 108.142 175.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -114.04 -168.97 1.43 Allowed 'General case' 0 C--N 1.273 -2.742 0 N-CA-C 108.435 -0.95 . . . . 72.35 108.435 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 31.9 t60 -54.14 -28.71 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 124.006 0.922 . . . . 63.54 111.97 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -75.01 -12.69 60.39 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.01 0.433 . . . . 73.42 110.888 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 79.76 25.18 58.83 Favored Glycine 0 N--CA 1.433 -1.554 0 N-CA-C 112.122 -0.391 . . . . 64.31 112.122 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -130.66 149.87 74.79 Favored Pre-proline 0 C--N 1.308 -1.207 0 N-CA-C 107.129 -1.434 . . . . 71.02 107.129 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . 0.493 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 12.3 Cg_endo -57.35 130.48 39.46 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.379 2.053 . . . . 73.41 111.576 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 16.3 m -81.35 9.07 7.73 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.299 -0.864 . . . . 74.52 111.033 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 80.6 23.33 60.45 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 109.871 -1.292 . . . . 61.45 109.871 -176.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -142.13 141.25 32.66 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.508 -1.293 . . . . 70.45 107.508 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.51 160.29 28.96 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 122.556 0.342 . . . . 53.51 110.31 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . 0.425 ' HB3' ' HE2' ' A' ' 528' ' ' MET . 70.2 m-85 -118.97 144.41 46.5 Favored 'General case' 0 C--N 1.291 -1.974 0 N-CA-C 109.189 -0.671 . . . . 75.31 109.189 175.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.5 131.52 44.24 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 107.577 -1.268 . . . . 74.32 107.577 174.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . 0.589 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 33.6 tt0 -104.98 131.94 51.87 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 108.165 -1.05 . . . . 70.51 108.165 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' MET . . . . . 0.632 ' SD ' HD11 ' A' ' 447' ' ' ILE . 67.9 mtp -104.43 178.07 4.67 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 123.008 0.523 . . . . 73.34 110.241 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -74.3 -36.05 63.72 Favored 'General case' 0 N--CA 1.407 -2.592 0 C-N-CA 123.329 0.652 . . . . 74.35 111.841 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 69.3 m -144.64 153.66 41.99 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 113.085 0.772 . . . . 71.04 113.085 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.05 68.77 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.523 1.129 . . . . 74.41 111.98 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.56 -49.3 77.93 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 115.783 -0.644 . . . . 72.21 111.62 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.85 -28.7 55.58 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.298 -0.561 . . . . 65.34 111.552 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.67 -43.57 96.31 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.512 0.507 . . . . 73.1 109.858 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -69.3 -38.86 78.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.314 0.578 . . . . 75.03 109.457 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.92 -44.01 97.78 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.285 -0.87 . . . . 42.43 109.622 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.8 97.97 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.877 -0.601 . . . . 45.33 110.6 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . 0.442 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -71.58 -22.94 61.66 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 112.079 0.4 . . . . 73.31 112.079 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -85.72 -42.17 14.48 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.602 -0.518 . . . . 64.33 109.602 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -70.48 -38.47 74.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.84 -0.618 . . . . 70.04 109.997 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 56.6 m -107.84 23.8 13.91 Favored 'General case' 0 N--CA 1.421 -1.885 0 CA-C-N 115.831 -0.622 . . . . 73.41 110.92 -177.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 29.3 t-80 -64.93 97.25 0.22 Allowed 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.606 -0.887 . . . . 71.21 108.606 172.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 97.9 mttt 59.32 62.55 1.77 Allowed 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.362 1.065 . . . . 71.32 110.341 -179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -103.71 134.04 47.69 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 114.919 -1.037 . . . . 71.43 109.049 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -73.32 133.33 43.83 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 116.013 -0.54 . . . . 72.31 110.919 -176.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.8 ttt -126.37 104.31 8.11 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 107.95 -1.13 . . . . 70.01 107.95 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.29 -72.66 0.1 Allowed 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 124.825 1.25 . . . . 75.45 110.782 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -141.16 -13.12 0.92 Allowed 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 112.754 0.65 . . . . 54.02 112.754 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 517' ' ' TYR . 0.0 OUTLIER -124.92 149.72 47.3 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 108.246 -1.02 . . . . 73.41 108.246 -174.388 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . 0.403 ' N ' ' HD3' ' A' ' 516' ' ' ARG . 55.7 m-85 -88.25 128.56 35.47 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 112.714 0.635 . . . . 73.12 112.714 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 91.2 t -96.2 112.39 28.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.128 -1.396 . . . . 72.23 107.343 176.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -97.59 114.78 26.77 Favored 'General case' 0 C--N 1.269 -2.892 0 N-CA-C 106.973 -1.492 . . . . 74.51 106.973 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 78.4 t -104.08 123.71 58.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.883 -0.599 . . . . 73.31 109.884 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -121.63 147.92 45.23 Favored 'General case' 0 C--O 1.208 -1.116 0 C-N-CA 124.003 0.921 . . . . 74.03 108.842 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -95.66 152.43 18.46 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.226 0.466 . . . . 73.02 110.939 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.4 m -152.15 170.71 19.31 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 123.128 0.571 . . . . 73.51 110.592 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 35.1 t -105.38 156.78 17.85 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 116.212 -0.449 . . . . 63.14 109.976 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . 0.475 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -57.73 -42.89 84.77 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.217 0.451 . . . . 72.13 112.217 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.09 -31.49 70.26 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.68 0.753 . . . . 72.44 109.46 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -72.61 -37.26 68.15 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.999 -1.0 . . . . 51.42 110.678 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' MET . . . . . 0.515 ' HE1' ' SG ' ' A' ' 446' ' ' CYS . 42.8 ttm -61.44 -44.88 96.33 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.655 -0.868 . . . . 62.4 108.655 175.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -62.41 -38.08 88.29 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.797 -1.092 . . . . 72.42 110.21 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -58.3 -47.89 82.24 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.691 0.796 . . . . 54.42 109.925 177.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.79 -34.42 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.174 0.511 . . . . 54.43 110.302 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 85.0 mt -71.21 -27.64 63.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.355 -0.384 . . . . 64.35 111.722 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 24.6 mmt -81.17 7.28 11.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.169 0.509 . . . . 72.02 110.898 177.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 72.17 28.21 68.68 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.33 -0.85 . . . . 37.62 110.995 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . 95.24 157.78 32.49 Favored Glycine 0 N--CA 1.414 -2.789 0 N-CA-C 109.726 -1.35 . . . . 74.32 109.726 -176.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 21.2 m -136.9 120.43 17.11 Favored 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 108.984 -0.747 . . . . 54.24 108.984 178.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 84.8 mt -102.99 92.19 4.45 Favored 'General case' 0 C--N 1.281 -2.399 0 N-CA-C 107.733 -1.21 . . . . 70.02 107.733 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -96.15 159.23 15.06 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 116.068 -0.515 . . . . 51.02 109.657 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -106.06 164.4 12.01 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-N 115.781 -0.645 . . . . 74.03 109.515 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 6.8 mp -89.76 86.56 6.7 Favored 'General case' 0 C--N 1.289 -2.064 0 CA-C-O 121.376 0.608 . . . . 71.24 109.741 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 . . . . . 0 N--CA 1.425 -1.697 0 CA-C-N 114.882 -1.053 . . . . 72.14 109.475 178.013 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 CA--C 1.511 -0.55 0 N-CA-C 109.321 -0.622 . . . . 73.23 109.321 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -64.95 140.15 65.03 Favored 'Trans proline' 0 C--O 1.245 0.827 0 C-N-CA 122.19 1.927 . . . . 71.11 111.366 175.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -55.69 126.72 23.4 Favored 'Trans proline' 0 C--O 1.242 0.699 0 C-N-CA 122.746 2.298 . . . . 72.23 110.385 175.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.8 m 63.03 56.14 1.85 Allowed 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 122.544 1.164 . . . . 73.34 109.302 -176.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -67.08 164.65 17.46 Favored 'General case' 0 C--O 1.25 1.108 0 CA-C-N 114.251 -1.34 . . . . 75.43 110.053 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 39.0 t -55.22 142.1 10.3 Favored 'Isoleucine or valine' 0 C--O 1.252 1.211 0 C-N-CA 124.177 0.991 . . . . 71.42 111.927 -174.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.528 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 98.6 mtt180 -89.5 70.26 7.96 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.099 -0.955 . . . . 74.03 109.991 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -123.22 18.7 9.9 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.256 -1.338 . . . . 72.14 110.497 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 63.6 m -113.43 156.82 22.81 Favored 'General case' 0 N--CA 1.417 -2.116 0 C-N-CA 119.682 -0.807 . . . . 75.5 109.424 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -129.18 139.11 52.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 N-CA-C 108.508 -0.923 . . . . 75.31 108.508 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 -108.2 120.93 43.77 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 107.045 -1.465 . . . . 73.11 107.045 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . 0.451 ' HA ' ' O ' ' A' ' 519' ' ' GLU . 12.3 mt -100.11 145.54 27.85 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.848 -1.538 . . . . 70.24 106.848 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -141.15 137.06 32.45 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 109.998 -0.371 . . . . 73.43 109.998 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 94.41 34.45 6.36 Favored Glycine 0 C--N 1.298 -1.548 0 CA-C-N 115.964 -0.562 . . . . 75.12 113.047 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 88.1 mt -75.3 150.31 85.03 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 116.881 0.341 . . . . 43.55 111.159 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.7 156.24 58.61 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 C-N-CA 122.868 2.379 . . . . 61.41 112.207 176.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -75.31 93.63 2.91 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.029 -1.442 . . . . 75.14 109.731 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 85.07 38.71 0.02 OUTLIER 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 111.841 -2.436 . . . . 75.14 111.388 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.24 137.49 57.04 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.205 -1.035 . . . . 74.2 108.205 169.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 15.4 p -81.5 156.93 25.03 Favored 'General case' 0 N--CA 1.416 -2.156 0 CA-C-N 116.66 -0.246 . . . . 65.21 110.535 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.454 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 63.3 mt -63.17 -32.52 56.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.746 0.784 . . . . 72.05 109.202 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -67.27 -36.14 80.97 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.486 -0.779 . . . . 71.21 110.216 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . 0.448 ' CG ' ' HZ2' ' A' ' 514' ' ' LYS . 22.8 t70 -74.08 -35.83 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.185 -0.462 . . . . 63.24 110.372 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.421 HG21 ' O ' ' A' ' 458' ' ' ILE . 12.5 tt -73.35 -33.47 40.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 120.443 -0.503 . . . . 71.22 110.286 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.3 mt -67.71 -35.46 78.83 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.409 0.623 . . . . 72.32 109.526 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.28 -49.85 74.03 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-N 115.213 -0.903 . . . . 72.3 109.45 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -51.88 -44.97 63.95 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.025 -1.443 . . . . 74.2 111.002 177.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.9 -36.56 83.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.388 -0.823 . . . . 73.23 111.648 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 72.87 -132.17 16.9 Favored Glycine 0 CA--C 1.476 -2.367 0 C-N-CA 120.396 -0.907 . . . . 74.43 111.246 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -52.32 -36.37 53.11 Favored 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 124.973 1.309 . . . . 72.44 109.795 176.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -70.33 -5.8 30.57 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.101 -0.954 . . . . 73.22 112.756 -176.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -72.85 -15.51 61.61 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.421 0.629 . . . . 74.42 109.769 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 28.5 m -91.06 -16.91 27.1 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 121.748 0.785 . . . . 55.31 109.263 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . 0.483 ' O ' ' HG3' ' A' ' 495' ' ' MET . 69.2 m-20 -98.26 0.15 45.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.84 -0.618 . . . . 75.15 112.549 -174.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 14.2 tt -79.06 158.39 4.7 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 N-CA-C 108.378 -0.971 . . . . 74.24 108.378 176.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -87.93 157.57 18.91 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.785 -1.191 . . . . 73.33 107.785 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.2 m -52.19 107.13 0.18 Allowed 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 124.028 0.931 . . . . 74.13 112.298 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 49.3 m80 61.94 29.08 17.7 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.298 1.039 . . . . 70.44 111.408 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 493' ' ' ILE . . . -78.06 -3.11 84.41 Favored Glycine 0 N--CA 1.439 -1.159 0 CA-C-N 115.63 -0.714 . . . . 73.03 112.774 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 5.0 p -83.07 103.24 10.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.17 0 CA-C-O 121.507 0.67 . . . . 74.31 110.686 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -114.99 91.75 3.72 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 116.246 -0.434 . . . . 72.24 110.116 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' MET . . . . . 0.404 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 69.8 mtm -77.54 129.07 35.19 Favored 'General case' 0 CA--C 1.489 -1.392 0 N-CA-C 106.23 -1.767 . . . . 62.44 106.23 173.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.0 t -81.13 118.39 28.82 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-O 121.47 0.653 . . . . 72.0 110.523 -173.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 69.8 mt -96.59 152.84 18.25 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.451 -1.314 . . . . 72.04 107.451 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -92.59 -170.44 2.47 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 107.883 -1.154 . . . . 71.14 107.883 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -72.15 -5.2 33.84 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 124.022 0.929 . . . . 71.01 113.275 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -109.87 12.07 24.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-O 121.505 0.669 . . . . 53.44 109.525 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 68.05 31.78 75.69 Favored Glycine 0 CA--C 1.505 -0.558 0 CA-C-N 115.604 -0.725 . . . . 72.11 112.88 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -121.45 142.21 35.02 Favored Pre-proline 0 C--N 1.305 -1.342 0 N-CA-C 107.0 -1.482 . . . . 74.12 107.0 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -52.42 129.86 33.63 Favored 'Trans proline' 0 N--CA 1.477 0.53 0 C-N-CA 123.161 2.574 . . . . 72.42 113.373 -177.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.7 m -77.39 -20.76 54.2 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.859 -0.609 . . . . 74.12 110.118 178.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 114.58 -18.6 17.32 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.66 -0.7 . . . . 75.5 111.699 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -112.78 164.45 13.37 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 120.929 0.395 . . . . 62.11 110.244 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . 0.404 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -155.17 160.28 40.78 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.628 -0.714 . . . . 53.54 109.083 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.52 120.27 25.09 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.518 -1.289 . . . . 74.43 107.518 174.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' A' ' 476' ' ' GLY . 1.7 mp -111.9 132.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.256 0 N-CA-C 108.393 -0.966 . . . . 70.02 108.393 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -103.45 121.98 43.94 Favored 'General case' 0 C--N 1.258 -3.392 0 N-CA-C 108.022 -1.103 . . . . 71.33 108.022 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 471' ' ' ASP . 2.0 tpt -92.9 171.45 8.96 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.533 -0.758 . . . . 50.33 109.987 -173.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -74.57 -36.59 63.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.007 0.923 . . . . 75.2 109.941 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.2 m -146.51 152.11 38.46 Favored 'General case' 0 N--CA 1.423 -1.819 0 CA-C-N 115.799 -0.637 . . . . 43.42 109.797 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.62 -36.49 78.73 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.108 0.88 . . . . 72.2 111.765 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -61.08 -48.82 79.95 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 115.504 -0.771 . . . . 75.43 110.388 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -68.87 -31.08 69.77 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.556 -1.202 . . . . 74.0 112.294 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.27 -48.29 70.9 Favored 'General case' 0 C--N 1.309 -1.175 0 O-C-N 123.392 0.433 . . . . 73.15 110.041 175.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -66.88 -38.98 87.32 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 116.053 -0.522 . . . . 74.24 110.312 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 47.5 tpp -65.81 -41.28 92.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.99 -0.55 . . . . 65.35 110.532 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.08 77.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 120.902 0.382 . . . . 71.42 110.401 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -71.36 -36.98 71.66 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.864 -0.607 . . . . 73.41 111.799 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -46.29 68.1 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 107.588 -1.264 . . . . 73.3 107.588 177.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -62.86 -33.5 75.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.894 -1.048 . . . . 63.44 110.53 -177.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . 0.462 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 61.9 m -116.05 19.66 14.86 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 114.83 1.419 . . . . 75.04 114.83 -176.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . 0.433 ' CD2' ' HD3' ' A' ' 510' ' ' LYS . 12.8 t60 -68.18 108.77 3.27 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 107.809 -1.182 . . . . 73.43 107.809 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.433 ' HD3' ' CD2' ' A' ' 509' ' ' HIS . 14.1 mptt 63.73 52.7 2.14 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 122.173 0.987 . . . . 53.21 110.45 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . 0.462 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 21.9 tptm -89.11 139.63 30.27 Favored 'General case' 0 N--CA 1.412 -2.344 0 CA-C-N 114.539 -1.21 . . . . 74.25 109.194 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -76.9 121.93 24.12 Favored 'General case' 0 C--N 1.284 -2.248 0 N-CA-C 108.188 -1.042 . . . . 72.32 108.188 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.444 ' HE2' ' OD2' ' A' ' 460' ' ' ASP . 25.6 ttt -105.84 77.31 1.24 Allowed 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.428 -2.064 . . . . 63.54 105.428 177.043 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . 0.448 ' HZ2' ' CG ' ' A' ' 460' ' ' ASP . 2.7 mppt? 69.75 -81.94 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.812 -1.54 . . . . 65.51 110.022 -172.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -125.67 -4.88 7.05 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-O 122.135 0.969 . . . . 65.24 110.872 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -94.22 160.12 14.83 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.016 -1.476 . . . . 71.23 107.016 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -120.35 118.27 29.94 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.722 -1.584 . . . . 70.23 106.722 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 96.0 t -112.79 134.6 54.88 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.996 0 CA-C-O 121.539 0.685 . . . . 72.13 111.458 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 449' ' ' LEU . 32.0 tt0 -95.5 114.31 26.06 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.399 -0.963 . . . . 74.12 108.399 176.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . 0.421 HG22 HD21 ' A' ' 449' ' ' LEU . 57.3 t -109.39 112.84 42.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 N-CA-C 107.729 -1.211 . . . . 60.32 107.729 176.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -128.31 123.39 33.9 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.218 -0.301 . . . . 70.54 111.751 -174.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . 0.401 ' OE1' ' HB3' ' A' ' 444' ' ' ARG . 0.6 OUTLIER -70.99 136.0 48.16 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.883 0.373 . . . . 72.2 110.928 -178.784 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 61.4 m -145.01 170.37 16.29 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 124.39 1.076 . . . . 75.24 109.307 -177.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.528 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 40.4 t -82.88 154.15 24.76 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.32 -0.622 . . . . 74.3 109.32 175.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -65.24 -23.57 67.1 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.433 -0.803 . . . . 63.11 109.489 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.98 -45.3 93.08 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.226 -0.657 . . . . 72.03 109.226 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -64.32 -40.63 96.29 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.075 0.464 . . . . 75.42 109.874 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' MET . . . . . 0.475 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.9 ttt -60.07 -47.64 85.05 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.361 -0.836 . . . . 63.42 110.382 178.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.15 -37.92 84.61 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 115.322 -0.854 . . . . 60.51 110.072 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -63.02 -43.0 99.93 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.255 -0.884 . . . . 75.44 110.01 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.83 -37.15 72.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 120.776 -0.369 . . . . 71.55 110.442 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.1 mt -66.28 -26.06 67.16 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.913 0.387 . . . . 63.24 111.804 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 93.2 mmm -91.48 7.08 42.94 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.549 0.69 . . . . 64.02 111.266 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 69.73 22.65 76.88 Favored Glycine 0 C--N 1.311 -0.847 0 CA-C-N 115.409 -0.814 . . . . 71.25 112.869 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -65.52 132.3 35.19 Favored Glycine 0 N--CA 1.412 -2.929 0 O-C-N 123.592 0.231 . . . . 75.02 112.93 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.9 m -139.41 102.74 4.55 Favored 'General case' 0 N--CA 1.419 -2.001 0 N-CA-C 107.879 -1.156 . . . . 74.22 107.879 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 67.1 tp -110.34 127.73 55.2 Favored 'General case' 0 C--N 1.285 -2.214 0 CA-C-N 115.76 -0.655 . . . . 63.43 110.19 -176.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -140.35 151.58 45.12 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.406 -0.961 . . . . 72.13 108.406 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -128.28 104.23 7.62 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.583 -0.525 . . . . 73.31 109.583 176.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.9 tt -91.29 99.2 12.22 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 106.529 -1.656 . . . . 74.13 106.529 178.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 . . . . . 0 C--N 1.295 -1.8 0 N-CA-C 108.342 -0.985 . . . . 65.4 108.342 -178.923 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 59.0 mtt . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 108.308 -0.997 . . . . 62.32 108.308 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -62.55 121.76 9.85 Favored 'Trans proline' 0 C--O 1.246 0.897 0 C-N-CA 122.752 2.301 . . . . 63.24 112.795 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -79.03 83.07 2.34 Favored 'Trans proline' 0 N--CA 1.441 -1.574 0 C-N-CA 122.098 1.866 . . . . 63.02 108.532 172.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 2.0 p -69.73 97.96 1.14 Allowed 'General case' 0 N--CA 1.423 -1.808 0 CA-C-N 115.122 -0.944 . . . . 74.53 112.048 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . 0.575 ' OD1' ' HB2' ' A' ' 524' ' ' SER . 0.1 OUTLIER -143.59 164.54 30.1 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.087 -0.961 . . . . 75.24 109.086 179.721 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 22.1 t -108.76 151.51 11.02 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.245 0 N-CA-C 107.199 -1.408 . . . . 63.24 107.199 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.513 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 95.5 mtt180 -94.01 75.42 4.13 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 122.313 1.054 . . . . 73.33 108.32 174.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.1 p30 -122.3 10.62 9.95 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 113.39 -1.732 . . . . 74.12 111.456 -172.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . 0.55 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 29.3 m -104.61 141.36 36.57 Favored 'General case' 0 N--CA 1.4 -2.947 0 N-CA-C 108.417 -0.957 . . . . 62.43 108.417 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -123.73 139.11 51.24 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.415 0 N-CA-C 107.766 -1.198 . . . . 72.31 107.766 -177.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . 0.458 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.4 ttp180 -114.38 123.95 50.74 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 108.948 -0.76 . . . . 71.44 108.948 175.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . 0.43 ' CD1' HD11 ' A' ' 461' ' ' ILE . 5.6 mt -102.11 138.1 39.5 Favored 'General case' 0 C--N 1.285 -2.235 0 N-CA-C 106.387 -1.709 . . . . 73.22 106.387 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 63.0 ttp180 -132.38 125.06 29.94 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-O 121.168 0.508 . . . . 62.21 110.15 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.42 45.69 1.41 Allowed Glycine 0 C--N 1.272 -2.985 0 CA-C-N 115.1 -0.954 . . . . 75.25 111.111 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 92.9 mt -84.19 140.26 39.49 Favored Pre-proline 0 N--CA 1.433 -1.309 0 O-C-N 122.86 -0.2 . . . . 74.04 110.547 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.55 150.75 33.71 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 123.208 2.606 . . . . 73.35 112.713 176.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -72.97 103.4 3.75 Favored 'General case' 0 N--CA 1.396 -3.169 0 N-CA-C 107.304 -1.369 . . . . 72.2 107.304 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 91.94 33.37 0.01 OUTLIER 'General case' 0 C--N 1.279 -2.469 0 CA-C-N 111.254 -2.703 . . . . 65.45 112.446 175.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -71.44 109.17 5.25 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 107.17 -1.419 . . . . 73.2 107.17 168.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.7 p -75.23 167.79 21.24 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.71 0.291 . . . . 72.33 110.791 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 59.7 mt -63.85 -32.49 57.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.983 0.421 . . . . 74.44 110.392 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.84 -49.75 69.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.306 0.574 . . . . 73.22 109.563 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . 0.415 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 34.1 t70 -67.32 -32.14 72.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.277 -0.874 . . . . 75.32 111.324 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.484 HG23 ' O ' ' A' ' 458' ' ' ILE . 11.2 tt -75.94 -30.37 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 109.959 -0.385 . . . . 75.21 109.959 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.6 mt -68.53 -35.03 76.9 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.25 -0.648 . . . . 73.44 109.25 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . 0.415 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 24.0 t70 -60.04 -51.68 68.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.21 -0.905 . . . . 72.22 109.242 173.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -55.16 -40.21 70.39 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.204 -1.362 . . . . 74.42 111.912 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.54 -31.96 73.3 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.982 -0.554 . . . . 75.32 111.911 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.83 -128.94 15.36 Favored Glycine 0 CA--C 1.474 -2.491 0 C-N-CA 120.447 -0.882 . . . . 54.54 111.922 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -58.93 -28.37 66.18 Favored 'General case' 0 C--N 1.273 -2.735 0 CA-C-N 113.802 -1.199 . . . . 72.12 111.698 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -75.74 -5.88 47.88 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 112.454 0.539 . . . . 74.23 112.454 -178.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.54 63.56 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.309 0.576 . . . . 60.53 111.422 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 16.4 m -97.85 -6.32 32.77 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 121.371 0.605 . . . . 64.12 109.971 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . 0.447 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 70.6 m-20 -99.22 -5.73 29.4 Favored 'General case' 0 C--O 1.242 0.69 0 O-C-N 121.94 -0.475 . . . . 61.13 112.2 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . 0.477 ' HA ' ' SD ' ' A' ' 495' ' ' MET . 13.0 tt -69.02 148.48 11.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 CA-C-N 115.273 -0.876 . . . . 71.53 109.897 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -72.28 173.39 8.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.132 -0.627 . . . . 73.11 110.499 176.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.9 m -62.05 102.83 0.31 Allowed 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.302 -0.863 . . . . 73.32 108.973 176.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 58.05 52.8 7.31 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.939 1.295 . . . . 74.0 108.281 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -73.72 -16.42 79.2 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.904 -1.044 . . . . 74.44 113.439 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.51 121.39 36.66 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-O 121.701 0.762 . . . . 74.32 111.45 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -132.95 106.84 7.92 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 107.515 -1.291 . . . . 73.35 107.515 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.9 mtt -88.12 139.57 30.37 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 120.214 -0.595 . . . . 74.43 110.306 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 61.8 t -83.54 107.19 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.481 -0.933 . . . . 62.41 108.481 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.7 mt -88.65 154.67 20.12 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 114.436 -1.256 . . . . 75.43 109.748 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -92.81 160.84 14.76 Favored 'General case' 0 C--N 1.284 -2.261 0 N-CA-C 104.72 -2.326 . . . . 73.42 104.72 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -64.51 -14.17 56.02 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 119.2 0.909 . . . . 75.54 112.031 -178.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -71.31 -16.72 62.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.414 0.685 . . . . 73.41 109.99 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.52 33.44 22.3 Favored Glycine 0 N--CA 1.435 -1.397 0 CA-C-O 121.941 0.745 . . . . 61.22 111.285 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -128.61 150.83 75.77 Favored Pre-proline 0 C--N 1.29 -1.98 0 N-CA-C 106.127 -1.805 . . . . 63.53 106.127 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.39 126.58 18.78 Favored 'Trans proline' 0 C--O 1.247 0.968 0 C-N-CA 121.587 1.524 . . . . 71.14 111.39 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 20.0 m -67.92 -24.86 65.24 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.605 0.716 . . . . 63.13 110.198 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 125.86 -20.15 6.44 Favored Glycine 0 N--CA 1.429 -1.784 0 N-CA-C 110.91 -0.876 . . . . 52.42 110.91 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -111.14 154.44 24.32 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.881 0.372 . . . . 61.11 110.752 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.59 40.81 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.286 -0.635 . . . . 63.35 109.286 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . 0.458 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 85.4 m-85 -118.36 137.48 53.08 Favored 'General case' 0 C--N 1.293 -1.871 0 N-CA-C 109.315 -0.624 . . . . 75.43 109.315 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 52.5 mt -125.3 124.95 68.27 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.202 0 N-CA-C 107.22 -1.4 . . . . 64.31 107.22 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -102.86 122.93 45.53 Favored 'General case' 0 C--N 1.27 -2.885 0 CA-C-N 115.683 -0.69 . . . . 71.14 110.247 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 472' ' ' ILE . 26.2 mmt -96.45 169.29 10.01 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 123.691 0.796 . . . . 75.42 111.608 -176.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -65.32 -32.47 74.14 Favored 'General case' 0 N--CA 1.421 -1.919 0 CA-C-N 115.492 -0.777 . . . . 64.32 112.737 178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 38.8 p -152.5 163.94 38.57 Favored 'General case' 0 C--O 1.25 1.106 0 CA-C-O 120.587 0.232 . . . . 73.52 111.389 -177.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.24 85.14 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 123.723 0.809 . . . . 63.41 111.443 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -54.45 -50.57 67.37 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.406 -0.816 . . . . 73.11 111.832 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . 0.447 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 2.4 mmp_? -64.53 -42.2 95.91 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 113.846 -1.524 . . . . 75.14 109.77 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.04 91.17 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.038 -0.983 . . . . 70.04 110.683 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -64.57 -41.62 96.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.816 -0.629 . . . . 55.14 110.893 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.0 mtp -74.09 -34.61 64.03 Favored 'General case' 0 CA--C 1.508 -0.64 0 C-N-CA 119.625 -0.83 . . . . 63.43 110.85 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.87 -40.4 79.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 116.25 -0.432 . . . . 71.33 110.09 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.7 -38.72 84.04 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 116.112 -0.494 . . . . 73.55 111.195 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -67.8 -42.38 81.66 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.497 -0.32 . . . . 74.11 110.927 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.4 -41.8 75.96 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 120.595 -0.442 . . . . 75.33 110.819 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 47.9 m -95.93 11.39 34.05 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 113.241 0.83 . . . . 65.31 113.241 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -66.17 97.6 0.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 O-C-N 121.324 -0.86 . . . . 74.42 110.861 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm 75.22 33.12 0.72 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.301 1.44 . . . . 71.22 109.484 175.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -80.59 150.4 29.53 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.462 -1.245 . . . . 73.14 109.817 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.15 143.56 33.77 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 120.69 0.281 . . . . 75.35 110.528 177.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.4 ttt -140.37 103.67 4.62 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.927 -1.138 . . . . 74.41 107.927 175.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp 66.81 -84.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 125.008 1.323 . . . . 63.42 111.013 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.31 -0.52 2.98 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.919 -0.771 . . . . 65.05 108.919 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -113.7 160.48 18.59 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.127 -1.064 . . . . 74.12 108.127 -172.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -113.45 118.85 35.65 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.659 -0.867 . . . . 74.23 108.659 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.85 112.66 35.73 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 CA-C-O 121.537 0.684 . . . . 64.12 109.558 -176.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -94.49 112.32 24.09 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 107.724 -1.213 . . . . 74.12 107.724 178.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.7 t -104.53 127.91 58.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 CA-C-O 121.111 0.481 . . . . 71.41 111.938 -176.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.78 148.36 48.18 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.502 -0.772 . . . . 75.53 109.365 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.55 142.06 32.54 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 122.41 0.284 . . . . 65.22 110.453 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.7 p -147.61 173.68 12.48 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.456 0.646 . . . . 75.15 111.839 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.575 ' HB2' ' OD1' ' A' ' 442' ' ' ASN . 80.3 p -85.02 158.99 20.31 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.217 -0.901 . . . . 74.4 110.584 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . 0.55 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -64.67 -29.04 70.04 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.968 -0.56 . . . . 65.32 110.038 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -73.93 -35.77 64.62 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 116.047 -0.524 . . . . 74.42 110.313 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -64.42 -47.14 80.27 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.379 -0.971 . . . . 73.12 108.379 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 23.5 ttt -60.45 -42.98 97.27 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.511 -1.222 . . . . 62.13 109.969 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -60.72 -45.51 93.99 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.017 -0.992 . . . . 74.43 109.63 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.59 -40.86 98.03 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.865 0.364 . . . . 74.1 111.076 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.25 -39.8 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.339 0.59 . . . . 72.4 110.751 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt -81.9 -19.75 40.21 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.649 0.611 . . . . 72.45 112.649 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 25.9 ttt -85.31 5.67 29.57 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.996 0.903 . . . . 75.22 110.505 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 75.94 35.71 43.87 Favored Glycine 0 N--CA 1.434 -1.447 0 CA-C-N 114.901 -1.045 . . . . 52.14 112.494 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -70.34 146.78 43.04 Favored Glycine 0 N--CA 1.41 -3.047 0 N-CA-C 111.806 -0.518 . . . . 71.42 111.806 178.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 8.4 t -71.51 137.66 48.31 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.119 0.485 . . . . 70.24 109.791 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.78 80.47 1.77 Allowed 'General case' 0 N--CA 1.425 -1.687 0 CA-C-O 121.931 0.872 . . . . 73.31 109.22 -177.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -148.28 156.03 42.05 Favored 'General case' 0 C--N 1.288 -2.091 0 N-CA-C 107.198 -1.408 . . . . 73.32 107.198 175.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -131.08 116.59 17.95 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-O 121.12 0.486 . . . . 62.23 110.916 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 83.0 mt -120.7 81.72 1.81 Allowed 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 105.972 -1.862 . . . . 63.02 105.972 172.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 . . . . . 0 N--CA 1.467 0.388 0 C-N-CA 124.394 1.077 . . . . 65.21 110.584 -174.387 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 72.4 mtm . . . . . 0 C--O 1.238 0.477 0 N-CA-C 109.604 -0.517 . . . . 52.44 109.604 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -85.06 164.76 11.46 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.284 1.989 . . . . 61.25 111.374 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -58.59 119.86 7.38 Favored 'Trans proline' 0 C--O 1.247 0.945 0 C-N-CA 122.131 1.887 . . . . 71.14 108.461 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 6.3 t -111.95 114.14 26.87 Favored 'General case' 0 N--CA 1.412 -2.335 0 CA-C-O 122.229 1.014 . . . . 75.02 113.316 -170.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -87.82 95.57 10.14 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 104.312 -2.477 . . . . 40.22 104.312 168.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.95 153.57 6.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.729 0 CA-C-N 115.419 -0.81 . . . . 74.41 110.584 -171.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.545 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 69.0 ttt180 -83.88 68.23 9.89 Favored 'General case' 0 N--CA 1.41 -2.459 0 N-CA-C 108.806 -0.813 . . . . 74.24 108.806 174.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . 0.419 ' HA ' ' HA ' ' A' ' 498' ' ' ALA . 14.5 p30 -119.66 16.38 12.79 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.229 1.012 . . . . 71.11 111.064 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 39.4 m -112.25 162.52 15.4 Favored 'General case' 0 N--CA 1.414 -2.257 0 N-CA-C 108.376 -0.972 . . . . 74.31 108.376 -176.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -128.18 138.42 54.73 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 N-CA-C 107.254 -1.387 . . . . 64.51 107.254 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -111.16 120.16 41.37 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 107.291 -1.374 . . . . 73.42 107.291 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . 0.421 HD22 HG22 ' A' ' 520' ' ' VAL . 11.1 mt -97.56 139.16 33.88 Favored 'General case' 0 C--N 1.283 -2.314 0 N-CA-C 106.325 -1.731 . . . . 64.34 106.325 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -138.1 132.32 31.86 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 109.226 -0.657 . . . . 72.23 109.226 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 102.83 38.56 2.91 Favored Glycine 0 C--N 1.289 -2.073 0 N-CA-C 110.441 -1.064 . . . . 64.04 110.441 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.82 138.03 96.34 Favored Pre-proline 0 C--O 1.243 0.75 0 CA-C-N 115.434 -0.383 . . . . 70.21 111.761 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.11 171.93 6.92 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.339 2.693 . . . . 63.23 113.41 176.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -77.65 99.51 5.82 Favored 'General case' 0 N--CA 1.394 -3.25 0 CA-C-N 113.44 -1.709 . . . . 74.01 108.959 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 79.57 33.42 0.21 Allowed 'General case' 0 C--N 1.272 -2.778 0 CA-C-N 112.157 -2.292 . . . . 74.31 112.005 170.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.38 113.31 2.85 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.149 -1.056 . . . . 65.3 108.149 171.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.6 p -80.12 170.09 16.92 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 116.361 -0.381 . . . . 74.24 111.336 -175.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.479 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.5 pt -61.43 -34.45 61.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 N-CA-C 112.225 0.454 . . . . 73.43 112.225 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.12 -33.77 63.69 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 119.625 -0.83 . . . . 73.13 110.66 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.27 -37.71 74.94 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.038 0.447 . . . . 53.52 110.511 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.413 HG23 ' O ' ' A' ' 458' ' ' ILE . 14.0 tt -70.65 -37.57 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 116.251 -0.431 . . . . 65.33 110.22 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 94.5 mt -67.62 -35.24 78.56 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.151 0.5 . . . . 74.1 110.121 177.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -62.95 -47.79 81.68 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.716 -0.675 . . . . 74.32 109.25 177.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -56.67 -42.87 79.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.562 -1.199 . . . . 74.42 110.938 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.77 -29.26 70.49 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.71 -0.677 . . . . 73.14 111.415 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.65 -121.13 21.41 Favored Glycine 0 CA--C 1.475 -2.468 0 CA-C-O 122.044 0.802 . . . . 63.43 113.088 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -51.75 -41.07 61.31 Favored 'General case' 0 C--N 1.266 -3.058 0 CA-C-N 112.675 -1.762 . . . . 63.03 111.405 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -82.36 1.87 35.09 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.608 -0.723 . . . . 75.14 112.52 -172.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -75.54 -15.67 60.35 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-O 121.078 0.466 . . . . 74.25 111.215 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 22.8 m -92.04 -14.47 29.29 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.342 0.592 . . . . 73.21 110.327 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . 0.442 ' CB ' ' HG2' ' A' ' 500' ' ' ARG . 2.9 m-20 -100.27 3.21 43.35 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 116.102 -0.499 . . . . 73.34 112.295 -176.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . 0.405 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.6 tt -73.31 148.79 8.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 N-CA-C 108.26 -1.015 . . . . 63.33 108.26 176.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . 0.405 ' O ' HG12 ' A' ' 472' ' ' ILE . 71.8 mtp180 -79.21 156.99 27.92 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.95 -1.13 . . . . 71.3 107.95 174.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 2.0 p -61.15 110.82 1.49 Allowed 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 112.487 0.551 . . . . 71.33 112.487 -178.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 63.21 35.26 12.78 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.664 1.186 . . . . 74.12 108.899 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.85 -10.52 83.62 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 114.854 -1.066 . . . . 71.3 111.202 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.2 p -81.21 105.07 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-O 122.162 0.982 . . . . 55.3 110.654 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -113.11 98.85 7.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.05 -0.977 . . . . 74.21 109.809 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 67.8 mtm -82.15 130.99 35.23 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.995 -1.113 . . . . 61.54 107.995 177.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . 0.491 ' O ' ' HA ' ' A' ' 487' ' ' PRO . 52.3 t -82.98 122.14 36.99 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 107.378 -1.342 . . . . 64.22 107.378 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.9 mt -99.99 154.9 18.02 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.226 0.536 . . . . 54.03 110.948 -175.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -102.72 175.66 5.42 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 105.417 -2.068 . . . . 64.25 105.417 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -60.0 -24.91 64.84 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.389 0.541 . . . . 73.43 110.713 -178.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . 0.473 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 8.6 tt0 -68.29 -17.24 64.23 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 123.684 0.794 . . . . 73.31 111.095 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.24 28.9 35.18 Favored Glycine 0 N--CA 1.441 -1.002 0 CA-C-N 116.151 -0.477 . . . . 65.03 112.168 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . 0.473 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 96.3 mtt180 -131.98 153.63 81.44 Favored Pre-proline 0 C--N 1.302 -1.474 0 N-CA-C 107.734 -1.21 . . . . 73.24 107.734 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . 0.491 ' HA ' ' O ' ' A' ' 480' ' ' VAL . 11.5 Cg_endo -56.32 133.25 56.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.514 2.143 . . . . 64.42 111.509 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 22.5 m -64.87 -12.57 50.21 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 123.751 0.82 . . . . 73.42 111.334 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 123.73 -12.72 8.24 Favored Glycine 0 CA--C 1.48 -2.108 0 N-CA-C 110.685 -0.966 . . . . 71.23 110.685 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -124.74 156.21 38.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-O 121.104 0.478 . . . . 72.24 110.601 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.5 150.79 29.97 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.195 -0.911 . . . . 70.11 108.751 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -112.04 127.87 56.02 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 108.906 -0.776 . . . . 75.14 108.906 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.54 128.75 73.8 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 107.921 -1.14 . . . . 73.41 107.921 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -104.29 124.36 49.03 Favored 'General case' 0 C--N 1.276 -2.589 0 CA-C-N 115.99 -0.55 . . . . 74.32 110.834 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -93.88 170.65 9.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.495 -0.775 . . . . 74.01 111.171 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -69.48 -28.54 66.16 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.87 -1.059 . . . . 73.02 110.097 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.5 m -154.42 151.16 28.66 Favored 'General case' 0 C--O 1.253 1.261 0 N-CA-C 109.332 -0.618 . . . . 74.31 109.332 -175.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.419 ' HA ' ' HA ' ' A' ' 445' ' ' ASP . . . -62.42 -25.71 68.1 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.119 0.968 . . . . 70.13 112.847 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -54.69 -51.65 64.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.811 0.815 . . . . 74.53 110.083 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . 0.442 ' HG2' ' CB ' ' A' ' 471' ' ' ASP . 10.1 mpt_? -65.88 -38.0 87.64 Favored 'General case' 0 CA--C 1.496 -1.127 0 CA-C-N 114.426 -1.261 . . . . 74.23 110.381 -176.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.44 88.91 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.45 -0.795 . . . . 54.22 110.84 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -68.66 -40.87 80.0 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.23 0.538 . . . . 61.42 110.177 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 66.6 mtt -70.31 -38.08 74.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.78 -0.646 . . . . 74.03 110.79 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.47 -41.98 83.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.305 -0.407 . . . . 64.21 110.37 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.41 -38.15 84.17 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 116.365 -0.38 . . . . 71.14 110.827 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -70.39 -39.51 74.47 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.747 -0.381 . . . . 73.21 111.1 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.57 -28.49 56.26 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.014 0.435 . . . . 74.42 111.128 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 39.7 m -114.99 18.56 16.31 Favored 'General case' 0 C--O 1.254 1.294 0 N-CA-C 113.13 0.789 . . . . 73.05 113.13 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -68.51 106.6 2.61 Favored 'General case' 0 C--O 1.243 0.715 0 O-C-N 121.052 -1.03 . . . . 73.22 109.868 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 81.3 tttt 72.53 29.8 2.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.833 1.253 . . . . 61.23 109.831 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.08 146.81 35.01 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.725 -1.125 . . . . 72.12 109.123 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . 0.443 ' HB3' ' CE2' ' A' ' 517' ' ' TYR . 9.0 p30 -87.28 137.28 32.47 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 120.525 -0.47 . . . . 43.5 111.171 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.5 ttt -125.42 91.65 3.46 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.511 -1.292 . . . . 74.04 107.511 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.6 -86.75 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.764 -1.107 . . . . 74.21 112.505 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.37 -27.16 13.61 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 113.424 0.898 . . . . 63.53 113.424 -172.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -130.6 157.84 41.63 Favored 'General case' 0 C--N 1.274 -2.69 0 CA-C-N 115.854 -0.612 . . . . 72.24 110.836 -167.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . 0.443 ' CE2' ' HB3' ' A' ' 512' ' ' ASN . 97.6 m-85 -95.56 125.85 40.44 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.152 -0.684 . . . . 75.51 109.152 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 66.7 t -106.92 117.24 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.543 0 CA-C-N 114.994 -1.003 . . . . 74.33 109.764 -175.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -81.7 110.6 17.19 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 107.125 -1.435 . . . . 52.14 107.125 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . 0.421 HG22 HD22 ' A' ' 449' ' ' LEU . 75.4 t -103.57 107.65 22.7 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 107.388 -1.338 . . . . 71.24 107.388 177.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -116.43 144.25 44.54 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.965 -0.754 . . . . 73.21 108.965 -175.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -89.04 123.8 33.68 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.769 -1.197 . . . . 55.1 107.769 -175.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 88.7 m -132.37 174.07 10.63 Favored 'General case' 0 C--N 1.283 -2.31 0 N-CA-C 113.434 0.902 . . . . 64.22 113.434 -169.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.0 t -103.6 154.09 19.88 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.096 -0.956 . . . . 73.02 111.779 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -69.49 -17.26 63.59 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.285 -0.871 . . . . 72.41 109.853 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.42 -46.28 33.68 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.875 -0.602 . . . . 72.31 109.725 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -71.57 -28.64 63.98 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.867 -0.79 . . . . 74.43 108.867 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' MET . . . . . 0.566 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.4 ttt -59.27 -51.64 69.07 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.392 -0.822 . . . . 75.24 109.213 174.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.92 -35.92 82.26 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.435 -0.802 . . . . 70.31 110.144 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.98 -47.79 83.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.533 -0.758 . . . . 72.31 110.583 175.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.15 -35.72 72.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.46 -0.336 . . . . 71.41 110.889 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 528' ' ' MET . 77.4 mt -67.89 -38.1 82.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.165 0.507 . . . . 73.43 110.018 178.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 48.2 ttm -70.41 -14.43 62.55 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.152 0.977 . . . . 54.23 110.803 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 70.64 36.97 67.73 Favored Glycine 0 C--N 1.282 -2.455 0 CA-C-N 114.313 -1.312 . . . . 75.21 110.579 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -57.67 135.07 52.09 Favored Glycine 0 N--CA 1.416 -2.692 0 O-C-N 124.479 0.752 . . . . 44.24 111.408 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 10.0 t -72.9 123.82 24.2 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-O 121.826 0.822 . . . . 65.32 110.877 -177.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 5.7 tt -127.76 94.34 3.93 Favored 'General case' 0 C--N 1.278 -2.524 0 N-CA-C 105.562 -2.014 . . . . 72.43 105.562 177.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -120.27 95.81 4.89 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-O 122.218 1.009 . . . . 71.34 108.566 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -87.97 107.3 18.65 Favored 'General case' 0 N--CA 1.426 -1.663 0 CA-C-N 114.803 -1.09 . . . . 50.21 108.922 -177.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . 0.429 HD23 ' O ' ' A' ' 540' ' ' LEU . 0.0 OUTLIER -67.32 115.19 6.7 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.81 0.814 . . . . 61.31 110.552 178.098 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 . . . . . 0 N--CA 1.426 -1.642 0 N-CA-C 107.592 -1.262 . . . . 74.13 107.592 -178.553 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 88.6 mtp . . . . . 0 CA--C 1.508 -0.65 0 N-CA-C 108.041 -1.096 . . . . 75.32 108.041 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.09 144.6 89.61 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.909 2.406 . . . . 71.33 113.021 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.36 -8.33 17.29 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.918 2.412 . . . . 73.42 112.021 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 23.4 p -86.94 -177.27 6.02 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 123.595 0.758 . . . . 72.34 109.211 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -68.08 112.29 4.96 Favored 'General case' 0 CA--C 1.5 -0.966 0 C-N-CA 120.149 -0.62 . . . . 61.44 110.117 175.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.6 t -61.18 148.86 8.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 124.426 1.09 . . . . 74.41 110.894 -178.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.555 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 8.0 ptp180 -83.89 65.35 8.58 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 122.024 0.916 . . . . 72.31 112.062 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -103.34 6.23 37.77 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.118 -0.946 . . . . 75.14 111.225 -178.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 38.4 m -107.91 155.08 20.69 Favored 'General case' 0 N--CA 1.415 -2.185 0 N-CA-C 108.852 -0.795 . . . . 53.11 108.852 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -132.57 141.18 45.8 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.379 0 N-CA-C 106.99 -1.485 . . . . 73.35 106.99 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.5 ttp180 -116.24 123.61 48.15 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.863 -0.792 . . . . 74.24 108.863 173.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 1.6 mt -97.5 135.14 39.78 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 105.82 -1.919 . . . . 75.43 105.82 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -136.39 135.0 38.41 Favored 'General case' 0 C--N 1.287 -2.126 0 C-N-CA 119.771 -0.772 . . . . 50.33 110.889 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 107.11 23.97 6.78 Favored Glycine 0 N--CA 1.432 -1.627 0 N-CA-C 110.399 -1.081 . . . . 52.01 110.399 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.72 144.61 97.88 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 112.965 0.728 . . . . 73.03 112.965 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -55.19 149.54 44.25 Favored 'Trans proline' 0 CA--C 1.492 -1.591 0 C-N-CA 123.107 2.538 . . . . 63.01 112.182 175.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -77.34 106.63 9.21 Favored 'General case' 1 N--CA 1.37 -4.465 0 N-CA-C 106.123 -1.806 . . . . 72.22 106.123 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 92.52 31.19 0.01 OUTLIER 'General case' 0 C--N 1.282 -2.343 0 CA-C-N 111.299 -2.682 . . . . 62.43 112.469 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.7 117.32 12.07 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.269 -1.382 . . . . 75.43 107.269 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.0 p -88.25 173.94 8.49 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.063 0.459 . . . . 65.31 111.722 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.442 ' O ' HD21 ' A' ' 462' ' ' LEU . 2.5 pp -64.02 -18.55 22.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.55 0.69 . . . . 73.43 111.881 175.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -79.85 -40.43 28.45 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 109.221 -0.659 . . . . 72.22 109.221 175.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.3 -43.58 94.28 Favored 'General case' 0 CA--C 1.497 -1.069 0 CA-C-N 115.859 -0.61 . . . . 53.01 110.731 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 458' ' ' ILE . 15.9 tt -68.93 -32.83 56.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.572 -0.74 . . . . 74.25 111.173 -176.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 458' ' ' ILE . 3.9 mm? -74.54 -36.3 63.14 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.79 0.328 . . . . 64.21 110.679 176.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.13 -47.97 82.19 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 108.789 -0.819 . . . . 74.12 108.789 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -52.56 -42.06 64.11 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 113.461 -1.699 . . . . 74.23 111.37 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 83.0 mt -63.63 -37.17 86.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.924 -0.58 . . . . 60.22 112.391 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.36 -130.33 18.4 Favored Glycine 0 CA--C 1.484 -1.844 0 C-N-CA 119.773 -1.203 . . . . 62.42 111.765 -177.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.92 -26.67 66.12 Favored 'General case' 0 C--N 1.274 -2.689 0 C-N-CA 124.463 1.105 . . . . 74.52 112.093 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -71.38 -11.73 61.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 74.32 111.511 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.36 -15.54 62.87 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.16 -0.473 . . . . 72.35 111.48 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.2 m -78.2 -28.05 47.95 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-O 121.099 0.476 . . . . 74.15 110.253 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -100.46 10.8 40.7 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.623 0.725 . . . . 74.11 111.507 -172.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 13.4 tt -67.94 142.92 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 N-CA-C 109.504 -0.554 . . . . 74.24 109.504 178.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -66.67 155.8 36.98 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.898 -1.149 . . . . 62.54 107.898 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 86.9 m -64.46 106.66 1.18 Allowed 'General case' 0 C--N 1.296 -1.744 0 O-C-N 123.403 0.439 . . . . 74.43 109.995 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 12.2 m170 64.2 27.78 13.96 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.988 0.915 . . . . 74.45 109.859 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.5 -19.32 70.74 Favored Glycine 0 C--N 1.337 0.621 0 CA-C-N 114.955 -1.021 . . . . 60.14 114.055 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.4 p -76.2 118.88 23.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-O 121.455 0.645 . . . . 63.51 110.403 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -134.07 111.49 10.4 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.809 -0.811 . . . . 74.21 108.809 -178.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 76.4 mtp -88.31 139.57 30.35 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.727 -0.789 . . . . 73.23 109.311 179.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.0 t -83.71 100.96 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 108.27 -1.011 . . . . 73.21 108.27 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.45 146.82 23.84 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.69 -1.226 . . . . 75.21 107.69 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -89.17 -172.97 3.86 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 108.304 -0.999 . . . . 64.4 108.304 -176.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -63.61 -26.83 68.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.104 0.478 . . . . 71.33 111.048 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -74.87 -7.21 52.82 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-O 121.482 0.658 . . . . 73.15 110.763 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.0 30.9 62.55 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.793 -0.523 . . . . 71.24 111.793 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -131.06 150.75 77.46 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 106.993 -1.484 . . . . 73.11 106.993 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.42 125.04 17.56 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 122.968 2.445 . . . . 72.03 114.2 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 38.4 m -69.31 -28.62 66.42 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.276 -0.875 . . . . 73.14 110.246 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 133.41 -21.07 4.1 Favored Glycine 0 CA--C 1.493 -1.307 0 CA-C-N 115.59 -0.732 . . . . 52.44 111.526 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . 0.435 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 20.3 p-10 -110.72 151.87 27.23 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.336 0.589 . . . . 64.22 111.302 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.77 155.27 36.86 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.662 -0.866 . . . . 64.22 108.662 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . 0.456 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 77.6 m-85 -111.48 142.11 44.18 Favored 'General case' 0 C--N 1.284 -2.255 0 CA-C-O 121.063 0.459 . . . . 73.53 110.456 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 67.8 mt -126.8 139.72 51.02 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 105.399 -2.074 . . . . 62.45 105.399 173.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -121.16 136.16 55.03 Favored 'General case' 0 C--N 1.274 -2.715 0 C-N-CA 119.905 -0.718 . . . . 71.0 109.443 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -103.9 173.7 6.19 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 123.686 0.616 . . . . 72.04 110.242 176.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -70.26 -42.08 72.62 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-O 121.197 0.522 . . . . 75.32 110.103 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' SER . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 500' ' ' ARG . 36.6 t -130.38 156.82 44.08 Favored 'General case' 0 N--CA 1.412 -2.331 0 CA-C-N 115.587 -0.733 . . . . 71.31 111.141 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.45 -28.36 66.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.79 -1.095 . . . . 75.42 111.262 -177.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.21 -47.82 84.35 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 116.185 -0.461 . . . . 75.54 111.434 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 497' ' ' SER . 0.5 OUTLIER -74.18 -32.75 63.2 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.031 -0.668 . . . . 74.12 111.076 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.34 96.34 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 123.447 0.467 . . . . 73.54 110.352 177.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -65.65 -42.6 91.24 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.869 -0.605 . . . . 74.31 110.038 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 16.0 tpt -67.91 -37.62 81.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.01 -0.541 . . . . 65.42 110.508 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.62 92.8 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.322 -0.399 . . . . 73.05 109.98 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.84 -38.71 86.93 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-O 120.72 0.295 . . . . 74.4 111.022 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -67.32 -41.38 85.38 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.831 0.348 . . . . 61.25 110.583 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -68.38 -39.59 81.69 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.869 -0.605 . . . . 54.04 110.79 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . 0.457 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 49.1 m -99.35 14.22 30.45 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 113.187 0.81 . . . . 71.13 113.187 -175.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -64.83 105.01 0.92 Allowed 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.013 -0.736 . . . . 72.22 109.013 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt 69.9 20.5 6.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.613 1.165 . . . . 61.53 111.648 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . 0.457 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 26.5 tptp -70.83 142.17 51.29 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 124.073 0.949 . . . . 71.3 109.076 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -97.97 143.28 28.71 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 119.319 -0.952 . . . . 62.11 110.848 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 44.3 ttm -111.16 114.32 27.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 104.544 -2.391 . . . . 72.13 104.544 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 97.4 mttt 67.16 -85.42 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.344 1.027 . . . . 64.41 109.011 -172.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -137.73 -8.89 1.63 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.466 0.65 . . . . 75.44 111.043 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -92.3 135.17 34.24 Favored 'General case' 0 CA--C 1.485 -1.524 0 N-CA-C 109.0 -0.741 . . . . 74.4 109.0 -175.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -87.01 132.25 33.85 Favored 'General case' 0 C--N 1.259 -3.335 0 CA-C-N 115.586 -0.734 . . . . 74.32 109.678 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 57.6 t -122.43 127.3 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 N-CA-C 108.727 -0.842 . . . . 70.52 108.727 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -93.68 115.6 28.06 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.742 -1.207 . . . . 73.34 107.742 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 94.3 t -104.34 127.06 58.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 CA-C-N 116.392 -0.367 . . . . 62.43 110.93 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -131.53 150.91 51.98 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.008 -0.542 . . . . 75.33 110.766 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -82.7 156.63 23.69 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.168 0.587 . . . . 62.05 110.098 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 66.0 m -157.23 166.56 32.82 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 122.966 0.506 . . . . 74.14 110.163 -176.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 58.5 p -97.06 155.28 16.87 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.916 -0.584 . . . . 65.31 110.32 177.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.45 62.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.127 -0.488 . . . . 61.05 111.688 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.99 -45.91 66.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.575 -0.528 . . . . 74.55 109.575 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.06 -41.7 97.26 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.418 0.628 . . . . 74.13 109.58 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -60.39 -44.41 95.69 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.788 -1.096 . . . . 73.31 110.81 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.13 -40.74 78.09 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.657 -0.498 . . . . 71.0 109.657 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.3 -41.94 97.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.903 -0.59 . . . . 74.41 110.986 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 96.0 t -72.6 -35.85 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 120.71 -0.396 . . . . 74.35 110.766 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 78.6 mt -76.29 -19.37 58.34 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.302 0.573 . . . . 73.13 111.399 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' MET . . . . . 0.41 ' HE2' ' HA ' ' A' ' 533' ' ' MET . 3.9 tpt -82.71 -8.8 59.57 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 122.308 1.051 . . . . 53.52 109.018 177.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 69.49 28.92 71.86 Favored Glycine 0 C--N 1.297 -1.628 0 CA-C-N 114.022 -1.445 . . . . 55.44 111.241 -177.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -77.96 142.87 26.99 Favored Glycine 0 N--CA 1.396 -3.983 0 N-CA-C 111.545 -0.622 . . . . 45.1 111.545 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 77.9 m -147.61 137.84 23.03 Favored 'General case' 0 C--N 1.289 -2.049 0 N-CA-C 108.03 -1.1 . . . . 75.34 108.03 176.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 56.6 tp -110.05 123.9 50.51 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 116.161 -0.472 . . . . 73.13 109.937 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -78.91 109.23 13.0 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.1 -0.5 . . . . 61.1 109.998 176.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -140.26 95.46 2.89 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.936 -0.764 . . . . 75.4 108.936 176.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 51.5 tp -86.37 89.37 7.85 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.054 -1.461 . . . . 72.44 107.054 177.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 . . . . . 0 N--CA 1.429 -1.489 0 CA-C-N 115.152 -0.931 . . . . 37.14 108.729 -174.781 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 50.5 ttm . . . . . 0 CA--C 1.503 -0.86 0 N-CA-C 108.82 -0.807 . . . . 74.51 108.82 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -58.99 127.8 25.56 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.169 1.913 . . . . 65.3 109.669 174.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -52.12 113.17 1.07 Allowed 'Trans proline' 0 C--O 1.245 0.826 0 C-N-CA 122.711 2.274 . . . . 74.31 110.859 177.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 29.1 m 66.18 75.16 0.34 Allowed 'General case' 0 N--CA 1.439 -0.977 0 O-C-N 124.513 1.133 . . . . 72.52 110.258 -174.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 34.0 p30 -76.22 143.42 41.03 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.569 -1.196 . . . . 72.43 109.473 177.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 52.5 t -119.43 142.45 34.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 108.674 -0.862 . . . . 75.33 108.674 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.564 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 32.3 mtp180 -93.67 67.82 3.92 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 119.645 -0.822 . . . . 73.1 109.353 178.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -99.2 12.54 35.88 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.589 -0.732 . . . . 73.1 110.966 -175.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 27.8 m -117.03 149.5 40.18 Favored 'General case' 0 N--CA 1.412 -2.325 0 N-CA-C 108.646 -0.872 . . . . 74.44 108.646 -178.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . 0.712 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.3 mt -126.96 151.03 33.33 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.76 0 N-CA-C 107.056 -1.461 . . . . 53.02 107.056 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -125.36 124.81 42.35 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.808 -1.182 . . . . 73.11 107.808 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 15.2 mt -100.78 142.66 31.94 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 107.117 -1.438 . . . . 73.14 107.117 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -144.3 126.99 16.14 Favored 'General case' 0 C--N 1.284 -2.263 0 CA-C-O 121.849 0.833 . . . . 74.41 110.669 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 108.63 32.75 3.05 Favored Glycine 0 C--N 1.279 -2.637 0 CA-C-N 114.754 -1.112 . . . . 61.43 110.781 -177.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 95.4 mt -59.98 140.93 90.23 Favored Pre-proline 0 C--O 1.241 0.616 0 N-CA-C 112.07 0.396 . . . . 73.14 112.07 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -61.08 170.57 4.75 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.104 2.536 . . . . 63.54 113.874 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.95 93.13 4.38 Favored 'General case' 0 N--CA 1.403 -2.785 0 CA-C-N 113.573 -1.649 . . . . 72.33 109.694 178.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 83.06 28.89 0.09 Allowed 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 113.007 -1.906 . . . . 70.03 112.695 171.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -61.4 132.67 54.25 Favored 'General case' 0 C--O 1.246 0.907 0 N-CA-C 108.686 -0.857 . . . . 65.53 108.686 173.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 73.1 p -95.97 176.52 6.08 Favored 'General case' 0 N--CA 1.418 -2.028 0 CA-C-O 121.695 0.759 . . . . 74.41 112.362 -174.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.478 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 31.9 pt -65.02 -26.32 39.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.06 0 CA-C-N 115.071 -0.968 . . . . 74.02 111.536 176.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -76.85 -32.29 57.43 Favored 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 119.473 -0.891 . . . . 74.45 110.19 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.84 -42.35 99.71 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.984 -0.553 . . . . 72.12 110.15 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 458' ' ' ILE . 11.8 tt -69.03 -36.03 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 120.606 -0.437 . . . . 71.45 110.666 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 97.6 mt -67.49 -38.99 85.19 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 120.951 0.405 . . . . 73.23 110.246 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -62.51 -51.3 67.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.464 -0.789 . . . . 63.5 109.327 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 94.4 t80 -55.94 -39.4 71.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 113.912 -1.495 . . . . 75.34 111.42 -178.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 71.5 mt -71.31 -32.78 69.02 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.765 -0.652 . . . . 63.21 112.666 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 73.28 -134.06 19.07 Favored Glycine 0 CA--C 1.48 -2.101 0 C-N-CA 119.252 -1.452 . . . . 51.11 111.244 -178.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -64.55 -21.57 66.73 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-N 114.629 -0.785 . . . . 54.41 111.158 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -67.08 -14.18 62.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.277 0.56 . . . . 74.33 110.535 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . 0.426 ' O ' HG23 ' A' ' 472' ' ' ILE . . . -71.27 -14.84 62.36 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.025 -0.534 . . . . 63.22 111.151 177.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 27.7 m -84.17 -23.98 30.37 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-O 121.776 0.798 . . . . 72.01 109.028 176.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -90.92 -11.27 39.62 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.44 -0.8 . . . . 72.34 111.999 -175.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . 0.426 HG23 ' O ' ' A' ' 469' ' ' ALA . 9.5 tt -77.17 132.92 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 N-CA-C 108.868 -0.79 . . . . 63.01 108.868 176.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 -72.71 159.34 33.97 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.942 -0.392 . . . . 71.1 109.942 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 72.1 m -57.18 113.1 1.58 Allowed 'General case' 0 C--O 1.246 0.92 0 CA-C-O 121.286 0.565 . . . . 75.32 111.761 -174.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 62.82 37.35 12.38 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 114.329 -1.305 . . . . 75.12 108.764 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -70.46 -14.29 71.84 Favored Glycine 0 N--CA 1.436 -1.356 0 CA-C-N 115.062 -0.972 . . . . 62.15 111.707 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.46 ' HA ' ' O ' ' A' ' 492' ' ' PHE . 4.2 p -83.38 101.85 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.87 0 CA-C-O 122.089 0.947 . . . . 74.31 110.588 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -107.78 101.87 11.13 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.45 -0.944 . . . . 75.45 108.45 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' MET . . . . . 0.494 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 46.5 ttm -80.59 137.09 36.35 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 120.908 0.385 . . . . 64.12 110.95 -177.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 59.5 t -90.36 111.46 23.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 CA-C-N 115.682 -0.69 . . . . 44.01 110.529 -177.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 2.2 pp -92.91 156.9 16.65 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.289 -0.868 . . . . 60.54 110.415 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -97.21 -169.03 1.79 Allowed 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.891 -1.522 . . . . 63.02 106.891 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -60.02 -30.17 68.99 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 123.342 0.657 . . . . 70.44 111.49 -178.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -73.63 -17.83 61.11 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.039 0.447 . . . . 73.42 110.891 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 89.77 19.41 47.98 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.481 -0.866 . . . . 71.5 111.884 -177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . 0.44 ' HD3' ' O ' ' A' ' 487' ' ' PRO . 0.1 OUTLIER -118.85 146.7 40.71 Favored Pre-proline 0 N--CA 1.445 -0.676 0 N-CA-C 107.211 -1.403 . . . . 75.51 107.211 179.252 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . 0.494 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 10.2 Cg_endo -53.39 133.2 52.15 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 C-N-CA 123.325 2.684 . . . . 75.34 113.265 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 21.1 m -80.02 0.02 33.54 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.674 0.75 . . . . 74.34 109.509 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 94.02 2.07 64.73 Favored Glycine 0 N--CA 1.426 -1.998 0 N-CA-C 110.411 -1.076 . . . . 53.52 110.411 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . 0.467 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 18.0 t70 -114.61 146.19 41.11 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.313 -1.366 . . . . 74.04 107.313 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -160.17 162.59 33.92 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 109.619 -0.512 . . . . 70.23 109.619 -177.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . 0.46 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 87.3 m-85 -115.73 145.87 42.4 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 120.646 0.26 . . . . 71.15 110.558 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.1 mt -118.07 134.88 60.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 105.988 -1.856 . . . . 74.44 105.988 172.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -118.72 109.66 16.35 Favored 'General case' 0 C--N 1.27 -2.861 0 N-CA-C 109.414 -0.587 . . . . 73.12 109.414 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' MET . . . . . 0.712 ' SD ' HD11 ' A' ' 447' ' ' ILE . 71.8 mtp -104.11 169.15 8.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.957 -0.565 . . . . 74.35 111.043 -175.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.22 -53.13 60.76 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 123.441 0.697 . . . . 74.0 111.775 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -121.2 146.04 47.2 Favored 'General case' 0 N--CA 1.419 -2.009 0 CA-C-N 115.669 -0.696 . . . . 64.34 112.142 -169.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.96 66.57 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-N 114.949 -1.023 . . . . 72.31 109.997 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -68.17 -46.91 69.45 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 122.103 0.954 . . . . 74.42 109.339 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -68.71 -38.78 80.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 114.02 -1.446 . . . . 75.04 109.274 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.14 -38.32 87.85 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.33 -0.85 . . . . 73.13 110.603 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -64.27 -42.54 96.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.585 -0.524 . . . . 73.43 109.585 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.3 mtp -61.88 -43.41 98.91 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.389 -0.369 . . . . 71.44 110.244 178.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.3 96.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.494 -0.775 . . . . 73.01 110.7 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.11 -30.28 67.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.969 0.414 . . . . 43.32 111.382 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -46.56 64.01 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.866 -0.606 . . . . 64.53 110.247 176.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . 0.497 ' HE3' ' HA ' ' A' ' 507' ' ' LYS . 1.4 tpmt? -75.7 -31.99 59.92 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.085 0.469 . . . . 73.41 110.582 -175.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 44.1 m -96.41 9.14 42.2 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 120.967 0.413 . . . . 73.43 111.918 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -63.47 101.85 0.37 Allowed 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.294 -0.632 . . . . 73.12 109.294 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 54.54 66.52 1.21 Allowed 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.532 1.533 . . . . 71.1 110.138 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -97.11 141.89 29.71 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 113.634 -1.621 . . . . 51.02 109.49 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . 0.422 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 0.8 OUTLIER -92.72 116.53 29.1 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 108.214 -1.032 . . . . 71.41 108.214 175.115 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.0 ttt -103.6 103.91 13.91 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 107.336 -1.357 . . . . 71.23 107.336 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 89.0 mttt 67.57 -77.91 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.372 1.069 . . . . 75.44 109.791 -175.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -135.4 -12.17 2.11 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 123.444 0.697 . . . . 60.22 110.926 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 28.2 tpt180 -88.83 152.75 21.57 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.035 -0.53 . . . . 72.14 109.723 -172.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.82 118.21 36.02 Favored 'General case' 0 C--N 1.291 -1.96 0 N-CA-C 107.356 -1.35 . . . . 72.44 107.356 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 60.0 t -114.5 116.98 54.2 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 109.046 -0.724 . . . . 61.11 109.046 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -95.95 110.87 23.01 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.604 -0.887 . . . . 71.24 108.604 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.51 135.21 44.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-N 115.999 -0.546 . . . . 62.01 111.868 -177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -126.35 162.22 26.02 Favored 'General case' 0 C--O 1.215 -0.728 0 C-N-CA 124.35 1.06 . . . . 72.13 109.19 176.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -100.71 157.61 16.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.815 -0.809 . . . . 73.24 108.815 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -156.68 163.43 39.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-O 121.892 0.853 . . . . 65.22 111.501 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 3.6 m -97.74 158.81 15.3 Favored 'General case' 0 C--N 1.271 -2.839 0 CA-C-N 114.722 -1.126 . . . . 63.51 108.555 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -57.24 -33.88 68.02 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 122.019 0.914 . . . . 72.23 108.869 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.4 -41.34 98.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.375 -1.284 . . . . 64.43 110.29 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . 0.427 ' O ' HG22 ' A' ' 531' ' ' VAL . 38.3 mt-10 -69.95 -36.53 75.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.213 -0.448 . . . . 73.45 110.095 178.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 46.2 ttm -63.7 -43.7 95.84 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.162 -0.681 . . . . 63.0 109.162 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -61.55 -40.28 94.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.212 -0.904 . . . . 74.14 109.593 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -63.69 -41.3 98.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.994 -0.548 . . . . 71.03 110.643 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 535' ' ' GLY . 98.9 t -65.35 -31.44 53.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.143 0.497 . . . . 63.22 110.499 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt -78.67 -37.6 41.46 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 121.317 0.579 . . . . 73.44 111.126 175.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 23.7 ttt -77.62 -40.41 42.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.948 0.88 . . . . 72.45 113.335 -174.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -118.08 -37.18 0.89 Allowed Glycine 1 C--N 1.25 -4.212 0 CA-C-N 114.383 -1.28 . . . . 71.23 113.023 -175.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . 0.449 ' O ' ' HA ' ' A' ' 531' ' ' VAL . . . 121.05 -171.24 14.77 Favored Glycine 0 N--CA 1.425 -2.043 0 N-CA-C 110.852 -0.899 . . . . 55.24 110.852 179.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.5 t -79.92 80.73 6.29 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-O 123.609 1.671 . . . . 72.21 109.18 175.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 55.9 tp -116.7 100.5 7.86 Favored 'General case' 0 C--N 1.27 -2.861 0 CA-C-N 112.359 -2.2 . . . . 73.35 110.113 -175.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -108.15 93.37 4.5 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 107.565 -1.272 . . . . 72.34 107.565 174.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -121.85 120.89 35.85 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 115.19 -0.914 . . . . 73.43 109.544 -172.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 28.4 tp -145.23 35.59 1.09 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 123.215 1.483 . . . . 75.31 108.596 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 . . . . . 0 C--N 1.273 -2.729 0 CA-C-N 112.963 -1.926 . . . . 72.43 107.031 179.674 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 25.0 ptt? . . . . . 0 C--O 1.221 -0.439 0 N-CA-C 108.64 -0.874 . . . . 73.44 108.64 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -86.44 111.15 1.0 Allowed 'Trans proline' 0 N--CA 1.439 -1.679 0 C-N-CA 121.504 1.469 . . . . 72.01 111.612 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -82.84 11.91 3.09 Favored 'Trans proline' 0 C--O 1.252 1.192 0 C-N-CA 123.457 2.772 . . . . 54.01 110.912 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.4 m -70.31 173.45 6.78 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 126.458 1.903 . . . . 73.51 108.43 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -69.81 87.73 0.53 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.624 0.725 . . . . 62.32 110.171 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.5 t -123.81 111.06 27.53 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 106.377 -1.712 . . . . 71.5 106.377 174.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.553 ' HA ' ' HA ' ' A' ' 524' ' ' SER 0.258 9.4 ptm85 -92.98 73.95 4.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 114.51 1.3 . . . . 72.23 114.51 -176.265 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.66 9.27 17.8 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.097 -0.956 . . . . 71.12 108.898 177.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 17.2 m -107.53 143.88 35.31 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 115.507 -0.769 . . . . 73.1 108.926 -176.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . 0.436 HD12 ' SD ' ' A' ' 495' ' ' MET . 3.2 mt -120.95 148.49 24.17 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.79 0 C-N-CA 123.758 0.823 . . . . 71.33 110.09 -176.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -126.58 122.52 35.3 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 107.254 -1.388 . . . . 74.15 107.254 176.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . 0.412 HD21 HG23 ' A' ' 520' ' ' VAL . 27.5 mt -108.55 153.71 22.98 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.267 -0.642 . . . . 64.43 109.267 -175.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . 0.414 ' HD2' ' OE2' ' A' ' 519' ' ' GLU . 32.6 ttm180 -142.15 147.56 36.85 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 107.402 -1.332 . . . . 61.4 107.402 172.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 86.24 34.61 12.08 Favored Glycine 0 C--N 1.306 -1.124 0 C-N-CA 120.304 -0.95 . . . . 61.53 114.045 175.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 86.4 mt -82.3 142.34 47.01 Favored Pre-proline 0 C--N 1.302 -1.476 0 N-CA-C 109.015 -0.735 . . . . 74.42 109.015 174.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.58 163.74 2.56 Favored 'Trans proline' 0 C--O 1.252 1.221 0 C-N-CA 123.126 2.551 . . . . 75.53 112.721 176.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -71.95 93.48 1.36 Allowed 'General case' 0 N--CA 1.412 -2.35 0 CA-C-N 114.538 -1.21 . . . . 74.33 110.094 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 78.66 36.46 0.19 Allowed 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 112.105 -2.316 . . . . 53.33 111.815 171.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -57.51 130.95 48.63 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.924 -1.139 . . . . 62.02 107.924 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.89 164.63 26.35 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-O 120.827 0.346 . . . . 64.23 110.439 -173.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.476 ' O ' HG23 ' A' ' 461' ' ' ILE . 61.0 mt -62.44 -35.43 69.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.848 0.832 . . . . 73.4 109.686 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -69.17 -29.96 68.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.762 -0.654 . . . . 61.14 110.512 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.62 -39.15 70.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.431 -0.804 . . . . 74.04 110.657 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.476 HG23 ' O ' ' A' ' 458' ' ' ILE . 13.4 tt -74.99 -33.41 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 116.237 -0.438 . . . . 60.21 110.455 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.26 -36.2 79.05 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.236 0.541 . . . . 74.4 110.059 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -61.11 -50.96 71.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.026 -0.988 . . . . 73.43 108.886 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -55.73 -38.85 70.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 113.847 -1.524 . . . . 62.43 111.739 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 87.1 mt -64.42 -35.27 80.36 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.114 -0.494 . . . . 62.14 111.901 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 68.52 -132.65 27.42 Favored Glycine 0 CA--C 1.48 -2.102 0 C-N-CA 119.776 -1.202 . . . . 51.41 112.685 178.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.97 -32.3 45.41 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.131 -1.035 . . . . 73.13 112.242 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -69.34 -14.38 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.083 0.468 . . . . 72.14 111.88 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . 0.486 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -69.96 -15.45 63.04 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.016 0.436 . . . . 65.42 110.596 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 21.0 m -77.11 -24.05 51.75 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 122.237 -0.289 . . . . 74.22 111.757 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . 0.412 ' OD2' ' HB3' ' A' ' 496' ' ' LYS . 30.6 t70 -106.2 -3.13 21.71 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.946 -0.471 . . . . 72.45 111.728 -178.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 469' ' ' ALA . 10.6 tt -59.84 146.11 10.63 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 CA-C-O 120.928 0.394 . . . . 72.12 110.771 -176.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . 0.451 ' NH2' ' HA ' ' A' ' 496' ' ' LYS . 15.2 tpp180 -74.1 139.38 44.56 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 105.773 -1.936 . . . . 73.25 105.773 175.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 21.4 m -72.03 116.42 12.42 Favored 'General case' 0 C--N 1.278 -2.536 0 N-CA-C 109.655 -0.498 . . . . 73.12 109.655 -173.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 9.6 m170 67.19 21.93 9.88 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.789 0.835 . . . . 74.25 111.554 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.79 -6.06 88.81 Favored Glycine 0 N--CA 1.439 -1.12 0 CA-C-N 115.252 -0.886 . . . . 61.3 111.316 177.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.4 p -84.44 119.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 CA-C-O 121.169 0.509 . . . . 70.23 109.921 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -134.69 120.52 19.6 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.05 -0.722 . . . . 74.54 109.05 -178.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 65.8 mtt -97.59 147.75 23.98 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 108.243 -1.021 . . . . 73.42 108.243 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.1 t -94.95 109.46 22.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 CA-C-O 121.602 0.715 . . . . 73.32 110.671 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 2.9 mp -98.87 146.49 25.91 Favored 'General case' 0 N--CA 1.427 -1.598 0 N-CA-C 107.545 -1.279 . . . . 75.04 107.545 172.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -90.08 -179.82 5.76 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.826 -1.546 . . . . 71.25 106.826 -175.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.9 -16.35 64.26 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 114.371 1.248 . . . . 65.35 114.371 -173.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -81.61 -10.08 59.52 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.515 0.674 . . . . 70.43 109.484 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.72 32.1 25.2 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.513 -0.767 . . . . 75.23 111.589 -177.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 30.3 mmt180 -119.31 131.87 24.2 Favored Pre-proline 0 C--N 1.309 -1.193 0 N-CA-C 107.959 -1.126 . . . . 74.12 107.959 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.47 129.76 35.57 Favored 'Trans proline' 0 C--O 1.243 0.76 0 C-N-CA 122.226 1.951 . . . . 74.11 111.205 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 8.0 p -73.95 -28.44 61.5 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.83 0.824 . . . . 72.53 108.982 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 120.72 -15.08 9.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 114.89 -1.05 . . . . 65.22 111.455 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -100.39 161.37 13.64 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 120.932 0.396 . . . . 71.14 110.155 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -159.38 177.56 10.85 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.923 -0.581 . . . . 73.52 109.818 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -135.12 143.03 46.35 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 124.566 1.147 . . . . 73.02 108.657 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 53.7 mt -139.73 135.77 39.17 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 N-CA-C 107.143 -1.429 . . . . 74.24 107.143 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -111.59 138.48 48.07 Favored 'General case' 0 C--N 1.272 -2.785 0 C-N-CA 118.934 -1.106 . . . . 75.02 108.415 175.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' MET . . . . . 0.436 ' SD ' HD12 ' A' ' 447' ' ' ILE . 79.0 mtp -104.71 -176.75 3.17 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.724 -0.843 . . . . 61.14 108.724 175.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.451 ' HA ' ' NH2' ' A' ' 473' ' ' ARG . 3.2 ttmp? -88.21 -39.31 14.57 Favored 'General case' 0 C--N 1.281 -2.384 0 CA-C-O 121.338 0.589 . . . . 61.04 109.642 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 15.6 m -114.26 141.67 47.27 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 115.1 -0.954 . . . . 75.23 111.502 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.11 67.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.207 -0.906 . . . . 62.24 109.02 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -67.27 -45.69 75.87 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-N 114.813 -1.085 . . . . 61.2 110.544 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -70.76 -36.19 72.98 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.507 -0.77 . . . . 70.35 110.346 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -61.67 -41.46 97.57 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 123.551 0.532 . . . . 70.14 110.331 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -62.24 -43.69 98.26 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.918 -0.583 . . . . 75.54 110.935 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 89.7 mtp -65.05 -41.24 95.35 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.172 -0.467 . . . . 74.05 110.516 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.81 -42.53 94.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.145 -0.48 . . . . 61.52 110.461 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.05 -38.49 85.92 Favored 'General case' 0 C--O 1.195 -1.807 0 CA-C-N 116.134 -0.484 . . . . 63.22 111.056 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.95 -42.84 72.7 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.476 0.655 . . . . 72.45 110.072 178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -68.29 -34.31 75.93 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.668 -0.696 . . . . 61.41 110.55 -177.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 34.7 m -115.1 19.01 16.0 Favored 'General case' 0 N--CA 1.425 -1.714 0 N-CA-C 112.993 0.738 . . . . 71.51 112.993 -174.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 34.7 t-80 -69.23 93.51 0.62 Allowed 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.511 -0.743 . . . . 71.24 110.299 176.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 45.6 tttp 71.0 30.04 2.83 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.399 1.479 . . . . 65.15 109.717 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.08 141.91 40.03 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.25 -1.341 . . . . 75.15 108.919 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -77.63 145.79 36.53 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-O 121.256 0.551 . . . . 65.42 110.797 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -129.77 102.17 6.21 Favored 'General case' 0 C--N 1.288 -2.091 0 N-CA-C 106.35 -1.722 . . . . 54.13 106.35 173.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 66.1 -81.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 124.712 1.205 . . . . 63.45 111.958 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -134.76 -2.37 2.66 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 123.399 0.68 . . . . 64.21 112.07 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -115.02 161.39 18.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 107.784 -1.191 . . . . 73.01 107.784 -176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -113.36 121.43 44.33 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.705 -0.479 . . . . 75.43 109.705 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 59.2 t -99.11 112.76 32.11 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.183 0 O-C-N 124.161 0.913 . . . . 71.45 108.638 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . 0.414 ' OE2' ' HD2' ' A' ' 450' ' ' ARG . 49.7 mt-10 -96.29 112.71 24.36 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.146 -1.057 . . . . 71.42 108.146 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . 0.412 HG23 HD21 ' A' ' 449' ' ' LEU . 93.6 t -104.38 115.6 46.59 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.24 0 CA-C-N 115.382 -0.827 . . . . 71.21 109.602 -177.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.99 147.94 32.56 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 108.491 -0.929 . . . . 73.31 108.491 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -105.34 153.36 21.74 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.259 -1.015 . . . . 72.13 108.259 -178.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.8 p -162.79 168.77 20.94 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.259 0.552 . . . . 72.35 111.906 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 69.3 m -91.9 160.14 15.43 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-N 115.359 -0.837 . . . . 62.32 112.444 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -51.73 -36.31 46.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.675 -1.148 . . . . 72.15 111.667 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -64.59 -51.14 64.27 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 108.967 -0.753 . . . . 73.23 108.967 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -39.08 90.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.024 -0.535 . . . . 71.22 111.101 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 528' ' ' MET . . . . . 0.504 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.2 ttt -66.81 -45.15 79.26 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.906 -0.588 . . . . 73.3 110.499 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -71.73 -31.56 66.83 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.806 -0.442 . . . . 75.51 109.806 -176.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -61.31 -47.37 86.24 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 123.899 0.88 . . . . 75.11 110.588 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 48.4 t -70.39 -35.09 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.332 -0.547 . . . . 72.2 109.588 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.2 mt -64.22 -42.64 96.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.195 -0.457 . . . . 71.24 110.822 178.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 22.2 mmt -70.06 -16.17 63.1 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.449 0.643 . . . . 72.22 111.866 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 77.97 44.07 12.77 Favored Glycine 0 C--N 1.273 -2.93 0 CA-C-N 114.702 -1.136 . . . . 72.41 111.19 -178.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -62.62 161.05 32.13 Favored Glycine 0 N--CA 1.427 -1.964 0 N-CA-C 111.404 -0.679 . . . . 50.22 111.404 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.4 m -66.92 110.52 3.37 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.581 0.705 . . . . 70.12 110.14 -176.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -142.42 92.06 2.38 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.087 -0.96 . . . . 75.25 108.902 -177.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -137.91 43.66 2.22 Favored 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 103.736 -2.69 . . . . 75.15 103.736 173.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -68.57 97.9 0.83 Allowed 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 111.749 -2.478 . . . . 65.0 112.485 -171.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.83 89.15 2.99 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 103.435 -2.802 . . . . 74.43 103.435 172.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 . . . . . 0 C--N 1.291 -1.949 0 N-CA-C 107.256 -1.387 . . . . 73.21 107.256 -171.633 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 CA--C 1.505 -0.763 0 N-CA-C 108.511 -0.922 . . . . 52.33 108.511 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . 0.45 ' HB2' ' O ' ' A' ' 441' ' ' THR . 59.0 Cg_endo -76.6 132.41 13.33 Favored 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 121.897 1.732 . . . . 74.55 110.802 177.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -61.32 -41.86 38.76 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.143 1.895 . . . . 71.11 110.592 177.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 439' ' ' PRO . 9.4 m -99.21 131.6 45.13 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 106.201 -1.777 . . . . 70.23 106.201 173.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -70.56 168.46 16.29 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 112.732 0.642 . . . . 73.42 112.732 -174.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.3 t -68.33 142.17 16.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 114.979 -1.009 . . . . 71.4 109.537 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.534 ' HG3' ' OG ' ' A' ' 524' ' ' SER . 7.6 mpt_? -102.28 67.02 1.02 Allowed 'General case' 0 C--O 1.209 -1.059 0 N-CA-C 110.026 -0.361 . . . . 73.14 110.026 -176.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -124.82 14.87 8.63 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 112.592 0.59 . . . . 63.11 112.592 -176.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 20.4 m -108.84 151.64 25.98 Favored 'General case' 0 N--CA 1.413 -2.284 0 N-CA-C 108.462 -0.94 . . . . 54.25 108.462 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.81 132.55 69.96 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.722 0 N-CA-C 108.655 -0.868 . . . . 73.53 108.655 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -106.02 121.41 44.07 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 108.356 -0.979 . . . . 75.12 108.356 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 18.3 mt -104.45 150.44 24.56 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.684 -1.228 . . . . 74.42 107.684 -177.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -146.52 131.63 18.32 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.853 -0.425 . . . . 73.03 109.853 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.32 41.06 2.12 Favored Glycine 0 C--N 1.289 -2.036 0 CA-C-N 115.737 -0.665 . . . . 65.54 111.653 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.06 130.85 89.38 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.16 . . . . 73.05 111.388 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.91 156.83 31.39 Favored 'Trans proline' 0 N--CA 1.447 -1.216 0 C-N-CA 122.808 2.339 . . . . 74.32 112.67 176.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -78.14 93.11 4.5 Favored 'General case' 0 N--CA 1.408 -2.537 0 CA-C-N 114.103 -1.408 . . . . 74.31 110.006 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.83 25.76 0.03 OUTLIER 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 112.732 -2.031 . . . . 72.41 113.325 172.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -69.39 135.87 50.9 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.375 -1.342 . . . . 72.15 107.375 172.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.2 p -89.26 174.7 7.69 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-O 120.884 0.373 . . . . 73.43 111.795 -175.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.436 ' O ' HG22 ' A' ' 461' ' ' ILE . 72.8 mt -61.48 -38.05 79.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 N-CA-C 108.886 -0.783 . . . . 71.52 108.886 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -64.73 -37.3 87.14 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.403 -0.817 . . . . 72.32 110.714 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -68.75 -43.4 75.92 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.061 0.458 . . . . 60.3 110.437 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.473 ' O ' ' HG ' ' A' ' 465' ' ' LEU . 12.6 tt -71.85 -33.0 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 CA-C-N 115.839 -0.619 . . . . 53.54 110.621 -175.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 8.1 mp -70.8 -30.64 67.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.9 0.381 . . . . 75.52 110.9 176.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.93 -48.23 66.53 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.207 -1.035 . . . . 61.32 108.207 175.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -54.63 -42.74 71.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.17 -1.377 . . . . 75.33 111.102 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 90.0 mt -64.95 -31.66 73.01 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.811 -0.631 . . . . 72.22 111.811 178.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 85.83 -149.41 23.28 Favored Glycine 0 N--CA 1.422 -2.268 0 C-N-CA 120.51 -0.852 . . . . 72.51 111.431 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -66.31 -22.52 66.28 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.031 -0.585 . . . . 63.41 111.005 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -62.81 -17.44 61.24 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.808 -0.633 . . . . 74.15 111.101 178.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -67.44 -15.32 63.61 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 116.059 -0.519 . . . . 72.54 110.979 178.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.3 m -85.83 -3.27 58.87 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.759 0.79 . . . . 65.31 109.508 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -112.93 13.95 19.65 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.996 -0.547 . . . . 74.32 110.771 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 15.8 tt -72.07 150.63 8.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.282 -0.872 . . . . 74.41 109.017 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -80.34 151.84 29.26 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 109.542 -0.54 . . . . 72.12 109.542 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 1.4 m -59.24 114.41 2.63 Favored 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.881 1.273 . . . . 74.4 109.704 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 59.93 33.21 21.46 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.746 0.818 . . . . 72.55 110.726 -178.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -98.35 37.04 3.64 Favored Glycine 0 N--CA 1.432 -1.584 0 CA-C-N 116.059 -0.519 . . . . 73.13 114.32 -174.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 59.0 t -118.41 111.47 34.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.304 0 N-CA-C 109.016 -0.735 . . . . 72.01 109.016 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 29.9 m-70 -127.65 100.47 5.99 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.243 0.544 . . . . 74.14 111.396 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 66.7 mtt -82.61 142.75 31.51 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.907 -0.775 . . . . 71.34 108.907 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 46.9 t -88.01 107.49 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.685 0 N-CA-C 107.214 -1.402 . . . . 62.22 107.214 176.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.8 pp -93.11 158.51 15.74 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.626 -0.715 . . . . 74.44 112.458 -178.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -91.93 173.2 7.97 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 106.342 -1.725 . . . . 75.13 106.342 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -56.05 -27.46 53.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.184 0.447 . . . . 75.24 111.219 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . 0.43 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 35.3 tt0 -69.41 -20.23 63.8 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 121.161 0.505 . . . . 72.45 111.345 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 90.87 25.58 24.49 Favored Glycine 0 N--CA 1.435 -1.403 0 CA-C-O 121.463 0.48 . . . . 37.03 112.898 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . 0.43 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 91.3 mtt180 -126.79 144.78 51.2 Favored Pre-proline 0 C--N 1.303 -1.445 0 N-CA-C 108.037 -1.097 . . . . 74.2 108.037 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -53.17 136.18 61.26 Favored 'Trans proline' 0 C--O 1.245 0.868 0 C-N-CA 123.113 2.542 . . . . 75.32 113.055 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.2 m -80.01 1.58 27.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.461 -0.79 . . . . 62.11 111.142 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.85 -30.0 6.57 Favored Glycine 0 CA--C 1.488 -1.656 0 N-CA-C 111.235 -0.746 . . . . 72.03 111.235 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -107.22 152.84 23.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.06 0.457 . . . . 70.41 110.86 179.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -158.11 169.38 24.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.498 -0.774 . . . . 71.12 109.184 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -127.71 129.88 47.87 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-N 116.182 -0.463 . . . . 75.25 109.775 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 43.3 mt -122.27 133.01 69.85 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.378 0 N-CA-C 105.977 -1.86 . . . . 74.34 105.977 172.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -108.54 136.57 47.92 Favored 'General case' 0 C--N 1.271 -2.812 0 N-CA-C 109.571 -0.529 . . . . 74.52 109.571 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.72 172.59 6.72 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 123.214 0.606 . . . . 62.13 111.442 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -65.07 -43.93 90.58 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.179 0.991 . . . . 75.13 110.181 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 51.0 p -141.03 155.98 46.09 Favored 'General case' 0 N--CA 1.42 -1.943 0 CA-C-N 116.302 -0.408 . . . . 73.5 111.785 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.54 -40.88 93.14 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.02 -0.991 . . . . 72.34 111.392 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.56 -37.84 87.85 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.093 -0.958 . . . . 71.43 111.932 -174.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -75.94 -40.77 53.39 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.405 -0.816 . . . . 71.4 109.741 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.34 -41.84 98.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.362 -0.835 . . . . 73.14 111.008 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -64.6 -40.06 94.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.855 -0.611 . . . . 74.15 110.978 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 55.6 ttm -70.32 -37.63 74.76 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.303 -0.559 . . . . 65.11 110.304 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.004 -0.544 . . . . 51.33 110.644 178.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.14 -32.18 70.04 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.076 -0.511 . . . . 74.23 111.836 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -72.89 -34.8 66.91 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.335 0.588 . . . . 55.33 109.772 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -68.69 -41.7 78.81 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.438 -0.801 . . . . 73.44 110.778 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 62.2 m -105.5 20.68 18.48 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 112.558 0.577 . . . . 71.13 112.558 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.89 92.32 0.23 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.384 0.611 . . . . 64.1 110.572 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 82.7 tttt 64.31 62.74 0.81 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.501 1.52 . . . . 74.41 110.041 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -105.82 139.38 40.48 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 113.429 -1.714 . . . . 64.45 107.763 179.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -75.78 140.72 42.5 Favored 'General case' 0 C--N 1.293 -1.879 0 CA-C-O 121.216 0.532 . . . . 72.24 111.268 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.7 ttt -126.19 90.68 3.23 Favored 'General case' 0 N--CA 1.415 -2.19 0 N-CA-C 105.576 -2.009 . . . . 75.44 105.576 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp 68.55 -84.86 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.928 -1.487 . . . . 72.44 110.573 -177.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -107.35 -35.87 6.67 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 115.966 -0.561 . . . . 74.54 112.082 -177.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.4 ttm105 -108.63 153.1 23.89 Favored 'General case' 0 C--N 1.273 -2.76 0 CA-C-N 114.992 -1.003 . . . . 65.0 109.833 -165.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -101.2 121.29 41.58 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 121.219 0.533 . . . . 73.22 112.083 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.55 109.97 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.277 0 CA-C-N 114.887 -1.052 . . . . 63.05 108.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -89.41 110.86 21.63 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 107.808 -1.182 . . . . 64.2 107.808 178.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 85.5 t -104.4 123.43 58.27 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.143 0 CA-C-N 115.874 -0.603 . . . . 73.03 109.501 -178.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -122.07 135.32 54.8 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.006 -0.739 . . . . 65.14 109.006 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.85 125.63 35.79 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 106.828 -1.545 . . . . 74.53 106.828 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 62.4 m -134.49 170.31 15.95 Favored 'General case' 0 C--N 1.284 -2.24 0 CA-C-N 115.348 -0.842 . . . . 70.13 111.014 -171.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.534 ' OG ' ' HG3' ' A' ' 444' ' ' ARG . 44.4 m -92.69 164.1 13.52 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 116.278 -0.419 . . . . 53.25 110.721 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.91 -23.05 63.19 Favored 'General case' 0 C--O 1.209 -1.063 0 CA-C-N 115.552 -0.749 . . . . 73.21 111.056 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.55 -50.31 70.0 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.146 -0.479 . . . . 72.4 110.379 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.6 -40.59 95.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.185 0.517 . . . . 70.12 110.607 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 528' ' ' MET . . . . . 0.5 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 27.8 ttt -67.01 -44.43 80.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.631 -0.713 . . . . 70.35 110.417 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.13 -35.95 80.82 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-N 116.12 -0.491 . . . . 71.41 110.164 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -62.73 -46.2 89.17 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.983 -0.553 . . . . 72.31 110.664 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 58.4 t -74.35 -31.79 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 120.327 -0.549 . . . . 73.21 110.911 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 528' ' ' MET . 73.3 mt -77.28 -27.14 53.0 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.909 0.385 . . . . 74.44 110.869 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 25.4 ttt -73.85 -24.03 59.71 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.762 1.268 . . . . 73.33 108.911 176.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 73.37 -6.03 17.98 Favored Glycine 0 C--N 1.281 -2.521 0 CA-C-N 113.141 -1.845 . . . . 64.25 113.362 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -73.51 136.54 22.28 Favored Glycine 0 N--CA 1.399 -3.78 0 N-CA-C 111.169 -0.772 . . . . 44.22 111.169 -178.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 44.5 m -151.18 133.54 15.4 Favored 'General case' 0 C--N 1.28 -2.451 0 N-CA-C 107.124 -1.436 . . . . 71.33 107.124 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 45.4 tp -124.62 61.98 1.14 Allowed 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.085 0.945 . . . . 71.53 109.107 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -105.49 86.5 2.42 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 107.039 -1.467 . . . . 73.42 107.039 176.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -160.21 111.12 1.89 Allowed 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 107.928 -1.138 . . . . 73.33 107.928 -176.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 8.5 mp -71.76 99.5 2.17 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 123.681 0.613 . . . . 63.24 110.414 -178.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 . . . . . 0 C--N 1.301 -1.504 0 N-CA-C 107.616 -1.253 . . . . 74.43 107.616 -178.899 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 CA--C 1.504 -0.813 0 N-CA-C 108.675 -0.861 . . . . 72.2 108.675 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.81 160.57 43.18 Favored 'Trans proline' 0 C--O 1.245 0.858 0 C-N-CA 122.627 2.218 . . . . 74.15 110.791 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.83 -5.11 15.67 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.159 1.906 . . . . 72.34 111.957 -177.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 39.4 m 73.97 150.12 0.11 Allowed 'General case' 0 C--O 1.242 0.661 0 C-N-CA 124.341 1.057 . . . . 70.31 109.628 -177.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -81.44 78.66 8.18 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.883 0.849 . . . . 71.2 109.215 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.61 155.55 7.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-N 113.792 -1.549 . . . . 72.11 109.522 -176.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' ARG . . . . . 0.644 ' HB2' ' NE2' ' A' ' 522' ' ' GLN . 22.1 ptt180 -87.25 51.91 2.36 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 122.545 1.164 . . . . 75.14 109.525 176.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -101.93 9.25 40.72 Favored 'General case' 0 C--N 1.3 -1.543 0 CA-C-N 114.144 -1.389 . . . . 75.23 111.288 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 44.3 m -107.54 149.36 28.09 Favored 'General case' 0 N--CA 1.412 -2.351 0 C-N-CA 119.559 -0.857 . . . . 65.03 109.948 -176.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' ILE . . . . . 0.657 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.5 mt -122.08 141.47 42.36 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.936 0 N-CA-C 106.892 -1.522 . . . . 71.05 106.892 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -116.63 124.94 51.01 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 108.101 -1.074 . . . . 74.14 108.101 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.6 mt -108.88 125.46 52.02 Favored 'General case' 0 C--N 1.279 -2.483 0 N-CA-C 106.038 -1.838 . . . . 75.45 106.038 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -136.52 137.26 40.11 Favored 'General case' 0 C--N 1.274 -2.709 0 CA-C-O 121.32 0.581 . . . . 72.4 110.372 -176.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 95.08 23.0 21.36 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 110.279 -1.128 . . . . 61.54 110.279 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.9 mt -60.11 145.46 85.15 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 123.899 0.88 . . . . 73.21 111.932 -178.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -59.98 158.96 27.3 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 C-N-CA 122.836 2.357 . . . . 64.21 113.707 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -77.17 95.1 4.2 Favored 'General case' 0 N--CA 1.396 -3.161 0 CA-C-N 113.004 -1.907 . . . . 75.34 109.683 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 87.74 26.84 0.04 OUTLIER 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 112.362 -2.199 . . . . 71.33 112.926 171.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -67.55 136.2 54.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.579 -0.737 . . . . 60.02 109.228 173.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 5.8 p -85.68 151.9 23.51 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 115.663 -0.699 . . . . 74.45 109.574 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.253 2.7 pp -62.3 -29.66 47.17 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.763 0 C-N-CA 120.003 -0.679 . . . . 73.34 112.606 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.86 -29.42 67.73 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.884 0.374 . . . . 70.42 111.224 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -75.51 -40.09 57.57 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.929 -0.767 . . . . 60.43 108.929 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' ILE . . . . . 0.404 HG21 ' HA ' ' A' ' 458' ' ' ILE . 12.4 tt -75.07 -28.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 C-N-CA 120.137 -0.625 . . . . 52.23 111.07 -179.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 87.0 mt -63.62 -34.84 78.71 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.676 -0.49 . . . . 75.2 109.676 175.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.19 -48.54 70.33 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.341 -0.985 . . . . 72.33 108.341 176.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.74 -41.18 70.09 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 113.992 -1.458 . . . . 74.22 111.2 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 97.0 mt -69.65 -37.39 76.73 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.013 -0.539 . . . . 75.52 110.325 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 87.29 -146.65 20.36 Favored Glycine 0 N--CA 1.418 -2.509 0 C-N-CA 120.758 -0.734 . . . . 63.24 112.97 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -49.75 -30.54 9.66 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 126.343 1.857 . . . . 73.04 113.275 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -61.62 -19.58 62.41 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.38 0.672 . . . . 72.51 112.368 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -61.9 -15.29 41.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.213 0.82 . . . . 73.43 113.213 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 12.8 t -86.58 -15.02 41.16 Favored 'General case' 0 CA--C 1.551 1.012 0 O-C-N 121.694 -0.629 . . . . 74.32 111.548 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -102.42 13.44 34.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.167 0.984 . . . . 51.3 110.469 -174.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 11.2 tt -73.53 152.62 7.31 Favored 'Isoleucine or valine' 0 C--O 1.248 1.013 0 CA-C-N 115.195 -0.911 . . . . 72.33 109.202 177.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -83.87 144.59 29.13 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 119.836 -0.745 . . . . 71.42 109.126 173.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 20.4 m -59.9 119.31 7.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.783 -0.821 . . . . 72.24 108.783 176.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 36.2 t-80 68.11 21.55 8.65 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.305 1.05 . . . . 72.03 109.257 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.75 -15.99 80.5 Favored Glycine 0 N--CA 1.438 -1.176 0 CA-C-N 115.512 -0.767 . . . . 63.0 112.296 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -83.67 123.81 39.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.445 0.641 . . . . 62.43 110.404 178.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -133.24 117.12 17.02 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.674 -0.861 . . . . 74.11 108.674 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.0 mtt -91.87 145.5 24.5 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-O 120.676 0.274 . . . . 64.23 110.341 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.9 t -84.61 96.33 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.545 0 N-CA-C 105.74 -1.948 . . . . 74.5 105.74 172.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.3 pp -96.03 161.42 13.99 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 114.209 -1.36 . . . . 71.32 113.356 -176.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.02 162.98 16.52 Favored 'General case' 0 C--N 1.282 -2.336 0 N-CA-C 104.098 -2.556 . . . . 71.24 104.098 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 64.3 m80 -70.31 -5.16 25.92 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 119.788 1.176 . . . . 72.25 112.411 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -83.39 -7.02 59.63 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.073 -0.967 . . . . 75.31 109.143 172.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 81.29 29.15 41.68 Favored Glycine 0 CA--C 1.495 -1.218 0 CA-C-N 115.746 -0.661 . . . . 55.44 112.859 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -117.43 127.41 26.69 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 108.669 -0.863 . . . . 61.32 108.669 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.78 126.63 19.39 Favored 'Trans proline' 0 C--O 1.243 0.772 0 C-N-CA 122.347 2.032 . . . . 52.23 111.197 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.6 m -74.95 -2.14 25.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.892 -0.594 . . . . 71.4 112.068 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 107.56 10.93 26.19 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.88 -0.676 . . . . 54.43 111.737 179.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -132.25 138.31 47.86 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.168 -1.419 . . . . 63.15 107.168 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.17 161.37 30.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.868 0.366 . . . . 52.04 110.73 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -122.9 142.81 50.39 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 123.3 0.64 . . . . 72.24 109.3 177.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 60.8 mt -128.62 126.5 65.37 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.228 0 N-CA-C 107.491 -1.299 . . . . 74.22 107.491 174.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -100.19 126.36 46.46 Favored 'General case' 0 C--N 1.275 -2.648 0 N-CA-C 109.539 -0.541 . . . . 51.31 109.539 177.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' MET . . . . . 0.657 ' SD ' HD11 ' A' ' 447' ' ' ILE . 82.9 mtp -100.47 170.38 8.43 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 108.364 -0.976 . . . . 74.44 108.364 177.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -80.82 -35.59 32.72 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.4 -0.592 . . . . 72.43 109.4 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.5 m -122.06 141.36 51.46 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-O 121.469 0.652 . . . . 73.13 111.205 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -76.18 -22.71 55.0 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.9 . . . . 71.44 111.84 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -70.97 -40.93 71.64 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.782 -0.644 . . . . 73.25 110.753 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -38.41 67.2 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.279 -0.873 . . . . 75.0 111.753 173.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . 0.416 ' HA ' ' SD ' ' A' ' 495' ' ' MET . . . -57.81 -44.73 86.54 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.196 0.522 . . . . 53.52 110.779 178.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -63.13 -39.2 94.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.631 -0.713 . . . . 74.52 110.426 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.85 -34.99 72.21 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.64 0.237 . . . . 75.04 111.64 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.15 -43.24 82.83 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.56 -0.533 . . . . 64.14 109.56 177.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -66.45 -29.67 69.85 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.897 -0.592 . . . . 74.23 110.901 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -71.52 -44.69 64.17 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.458 -0.571 . . . . 71.32 109.458 177.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.2 -44.51 96.42 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.611 -0.722 . . . . 73.44 110.347 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 58.9 m -98.71 10.44 41.14 Favored 'General case' 0 N--CA 1.421 -1.907 0 N-CA-C 113.513 0.931 . . . . 53.44 113.513 -173.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 32.7 t60 -77.06 104.35 7.5 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 119.439 -0.904 . . . . 73.23 109.453 174.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 73.01 19.43 3.7 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.72 1.208 . . . . 74.43 110.617 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.02 146.67 26.55 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.502 -1.296 . . . . 70.01 107.502 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -98.04 149.52 22.38 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 118.666 -1.214 . . . . 75.2 111.673 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.0 ttt -120.17 113.0 19.79 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 104.946 -2.242 . . . . 52.33 104.946 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.3 mttm 69.99 -87.19 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.118 -1.067 . . . . 72.33 108.118 -172.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.25 1.53 1.24 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.314 0.646 . . . . 74.41 111.417 175.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -103.99 142.58 34.19 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 107.566 -1.272 . . . . 74.43 107.566 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -95.24 125.35 39.82 Favored 'General case' 0 C--N 1.265 -3.077 0 CA-C-O 121.489 0.661 . . . . 73.31 110.7 -176.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 61.4 t -102.23 127.39 55.84 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.666 0 N-CA-C 106.881 -1.525 . . . . 72.2 106.881 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -103.77 109.21 20.84 Favored 'General case' 0 N--CA 1.411 -2.404 0 N-CA-C 108.221 -1.029 . . . . 75.44 108.221 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.0 t -106.73 134.28 48.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 CA-C-N 115.15 -0.932 . . . . 61.43 110.623 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -125.33 159.9 30.63 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.437 -0.949 . . . . 73.53 108.437 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' GLN . . . . . 0.644 ' NE2' ' HB2' ' A' ' 444' ' ' ARG . 1.0 OUTLIER -101.68 139.49 37.25 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.392 -1.336 . . . . 42.44 107.392 177.482 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 65.1 m -141.01 169.47 17.54 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.86 0.362 . . . . 62.41 110.724 -175.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.514 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.3 p -99.2 159.96 14.61 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.999 -0.546 . . . . 62.43 109.931 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -56.99 -30.88 64.52 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 123.614 0.571 . . . . 63.41 109.646 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.36 -52.56 57.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.377 1.071 . . . . 55.04 110.068 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -59.68 -42.81 93.75 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.675 0.75 . . . . 74.42 109.076 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 22.1 ttt -62.01 -45.04 95.33 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 114.586 -1.188 . . . . 74.52 110.199 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.99 -39.3 87.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.938 -0.573 . . . . 65.42 109.761 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -68.31 -39.12 82.12 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.079 -0.509 . . . . 71.34 110.764 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 91.5 t -73.3 -38.11 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 C-N-CA 120.233 -0.587 . . . . 63.13 110.469 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 92.3 mt -75.15 -19.3 59.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.204 0.526 . . . . 70.23 111.772 -178.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 27.8 ttt -86.05 -4.08 59.09 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.669 0.747 . . . . 75.54 110.442 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 66.22 40.69 94.92 Favored Glycine 0 C--N 1.305 -1.171 0 N-CA-C 110.139 -1.184 . . . . 36.44 110.139 -176.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -58.33 121.7 27.17 Favored Glycine 0 N--CA 1.411 -2.976 0 CA-C-N 114.556 -0.822 . . . . 60.42 114.175 -175.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 21.3 m -104.75 134.43 47.92 Favored 'General case' 0 C--N 1.269 -2.9 0 N-CA-C 105.797 -1.927 . . . . 75.5 105.797 175.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 4.3 tt -83.61 81.44 8.74 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 108.188 -1.042 . . . . 71.5 108.188 -177.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -108.5 83.59 1.8 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.733 -1.121 . . . . 74.32 108.218 178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -139.31 41.01 2.08 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.912 -1.514 . . . . 63.14 106.912 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.9 tt -86.5 121.84 29.61 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 113.331 -1.759 . . . . 70.1 108.378 -174.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 . . . . . 0 C--N 1.286 -2.195 0 N-CA-C 107.207 -1.405 . . . . 60.23 107.207 179.699 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 30.3 t . . . . . 0 N--CA 1.439 -1.007 0 N-CA-C 107.401 -1.333 . . . . 55.33 107.401 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.563 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 59.0 mtp85 -90.06 62.25 5.49 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 121.851 0.834 . . . . 74.51 109.813 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.2 p30 -111.43 11.73 21.46 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-N 115.005 -0.998 . . . . 71.41 110.168 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 494' ' ' GLN . 28.3 m -109.07 151.28 26.6 Favored 'General case' 0 N--CA 1.408 -2.539 0 N-CA-C 107.797 -1.186 . . . . 64.32 107.797 -177.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 447' ' ' ILE . . . . . 0.441 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.2 mt -132.13 143.9 38.7 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.39 0 N-CA-C 108.354 -0.98 . . . . 64.01 108.354 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -112.29 119.1 37.16 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 108.056 -1.09 . . . . 64.13 108.056 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 10.6 mt -94.42 141.5 28.51 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.505 -2.035 . . . . 71.13 105.505 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 450' ' ' ARG . . . . . 0.47 ' HE ' ' CG ' ' A' ' 490' ' ' ASP . 0.0 OUTLIER -142.65 135.83 28.48 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 119.53 -0.868 . . . . 75.02 109.861 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 451' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 450' ' ' ARG . . . 99.51 22.26 13.03 Favored Glycine 0 C--N 1.28 -2.576 0 CA-C-N 114.474 -1.239 . . . . 74.12 112.188 177.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.75 144.59 96.35 Favored Pre-proline 0 C--O 1.242 0.66 0 C-N-CA 122.883 0.473 . . . . 70.41 111.974 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -57.21 160.65 12.73 Favored 'Trans proline' 0 C--O 1.252 1.218 0 C-N-CA 123.395 2.73 . . . . 64.01 113.762 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -77.19 98.61 5.15 Favored 'General case' 0 N--CA 1.401 -2.903 0 CA-C-N 113.952 -1.476 . . . . 70.34 108.686 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.96 30.43 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.485 0 CA-C-N 111.966 -2.379 . . . . 65.51 111.971 172.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -54.2 121.87 9.09 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 108.425 -0.954 . . . . 62.34 108.425 171.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 7.2 p -81.02 169.35 17.61 Favored 'General case' 0 N--CA 1.414 -2.27 0 CA-C-N 115.963 -0.562 . . . . 70.02 111.952 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.651 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 16.2 tt -67.1 -31.69 54.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 CA-C-N 116.185 -0.461 . . . . 72.12 111.957 -174.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -80.25 -28.19 38.52 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.74 -0.784 . . . . 73.42 110.264 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.62 -40.1 80.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.14 -0.936 . . . . 70.11 108.968 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.5 tt -71.01 -32.88 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 115.41 -0.814 . . . . 75.22 110.065 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 93.1 mt -68.25 -40.08 82.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.327 -0.249 . . . . 75.55 110.327 178.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.97 -52.43 64.2 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 121.502 0.667 . . . . 60.22 109.28 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -53.97 -39.4 65.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.905 -1.498 . . . . 70.42 111.878 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 465' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 94.7 mt -72.64 -36.49 68.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.915 -0.584 . . . . 61.44 111.92 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.82 -140.41 25.86 Favored Glycine 0 N--CA 1.43 -1.72 0 C-N-CA 119.85 -1.167 . . . . 52.34 111.855 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.46 -17.85 63.15 Favored 'General case' 0 C--N 1.287 -2.133 0 CA-C-N 114.603 -0.798 . . . . 75.04 113.017 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -70.6 -22.02 62.59 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.352 0.596 . . . . 75.45 110.899 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.4 -14.65 62.65 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.453 0.644 . . . . 73.43 110.521 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 15.9 m -81.68 -18.21 45.31 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 116.201 -0.454 . . . . 74.32 111.222 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -112.97 16.13 19.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.998 0.904 . . . . 74.42 110.672 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -66.81 145.58 13.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.879 0 CA-C-N 115.761 -0.654 . . . . 73.1 109.438 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -78.5 155.29 29.88 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.3 -1.37 . . . . 64.14 107.3 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 12.3 p -54.75 114.22 1.62 Allowed 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 123.426 0.69 . . . . 51.14 111.382 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 63.11 26.19 15.24 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.69 0.796 . . . . 51.24 111.968 -176.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.18 70.88 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 116.291 -0.413 . . . . 71.11 113.596 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.2 p -85.7 114.26 25.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.894 0.854 . . . . 73.12 112.245 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -124.78 113.76 18.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.079 -0.964 . . . . 73.15 109.508 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 66.1 mtt -88.94 136.97 32.73 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.924 -0.769 . . . . 74.14 108.924 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.61 121.12 37.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 N-CA-C 108.93 -0.767 . . . . 73.33 108.93 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 85.6 mt -92.95 158.7 15.68 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.756 -0.831 . . . . 75.43 108.756 179.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -106.6 -174.64 2.58 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.78 -1.563 . . . . 74.12 106.78 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -53.8 -39.96 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.771 0.828 . . . . 70.13 111.858 -176.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -68.68 -12.7 61.71 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.563 0.745 . . . . 63.44 111.993 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 84.48 24.21 47.76 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.454 -0.658 . . . . 75.22 111.454 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -127.86 152.86 77.85 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 106.937 -1.505 . . . . 72.43 106.937 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -50.55 135.12 40.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.308 2.672 . . . . 62.13 114.914 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 43.2 t -76.16 -18.75 58.97 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.662 -1.154 . . . . 73.13 109.11 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 102.09 -2.07 51.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 109.091 -1.603 . . . . 74.14 109.091 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 490' ' ' ASP . . . . . 0.47 ' CG ' ' HE ' ' A' ' 450' ' ' ARG . 8.6 m-20 -104.95 143.65 32.87 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 107.545 -1.279 . . . . 72.34 107.545 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -151.67 148.53 28.05 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 108.737 -0.838 . . . . 61.12 108.737 175.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' PHE . . . . . 0.413 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 70.1 m-85 -122.43 127.82 50.12 Favored 'General case' 0 C--N 1.282 -2.367 0 N-CA-C 108.692 -0.855 . . . . 73.35 108.692 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.6 mt -124.7 128.23 73.26 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 N-CA-C 109.053 -0.721 . . . . 72.24 109.053 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 446' ' ' CYS . 35.6 tt0 -102.55 123.82 46.98 Favored 'General case' 0 C--N 1.282 -2.363 0 N-CA-C 109.485 -0.561 . . . . 74.32 109.485 177.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.459 ' HE2' ' HB3' ' A' ' 500' ' ' ARG . 80.4 mtp -96.97 171.63 8.37 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.537 -0.756 . . . . 73.42 109.092 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -74.69 -38.29 62.43 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 121.284 0.564 . . . . 53.1 110.074 -177.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' SER . . . . . 0.422 ' HB2' ' HD3' ' A' ' 500' ' ' ARG . 1.7 m -115.63 141.12 48.49 Favored 'General case' 0 N--CA 1.403 -2.776 0 CA-C-N 115.432 -0.803 . . . . 71.54 110.039 -172.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -75.75 -25.04 56.16 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.334 0.587 . . . . 74.24 110.795 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.6 -40.9 55.74 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.603 -0.726 . . . . 74.3 109.45 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' ARG . . . . . 0.459 ' HB3' ' HE2' ' A' ' 495' ' ' MET . 8.7 mpt_? -63.16 -41.48 99.25 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.839 -1.073 . . . . 70.31 110.647 174.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -59.82 -44.03 94.25 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.503 0.502 . . . . 73.41 110.685 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 75.43 110.468 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 4.2 tpt -62.62 -41.62 99.12 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.005 -0.543 . . . . 75.52 109.845 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.37 -39.9 89.4 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.305 -0.407 . . . . 72.22 110.927 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.53 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -72.57 -22.87 60.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.345 -0.389 . . . . 64.5 111.912 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -82.57 -44.6 15.66 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 109.024 -0.732 . . . . 71.32 109.024 176.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.88 -43.24 96.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.722 -1.126 . . . . 71.44 110.045 -178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 508' ' ' CYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 62.8 m -101.6 13.68 34.22 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 115.208 -0.905 . . . . 54.12 112.985 -175.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 509' ' ' HIS . . . . . 0.53 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 25.3 t-80 -68.47 92.19 0.43 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.911 -0.774 . . . . 54.42 108.911 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.474 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 81.1 tttt 67.46 70.46 0.36 Allowed 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.871 1.668 . . . . 75.11 109.637 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 511' ' ' LYS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 87.1 tttt -105.21 148.08 27.32 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 113.274 -1.785 . . . . 51.2 108.363 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -84.3 117.61 23.67 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.85 -0.74 . . . . 73.44 109.623 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.446 ' SD ' HG21 ' A' ' 518' ' ' VAL . 26.3 ttt -108.37 95.37 5.62 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 106.935 -1.506 . . . . 63.52 106.935 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt 69.57 -79.39 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.335 1.022 . . . . 73.52 111.123 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -135.23 -3.65 2.43 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.944 0.878 . . . . 73.02 110.65 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -109.83 162.1 14.81 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.693 -0.855 . . . . 75.14 108.693 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -112.62 117.7 33.01 Favored 'General case' 0 N--CA 1.426 -1.653 0 N-CA-C 108.277 -1.009 . . . . 65.42 108.277 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' VAL . . . . . 0.446 HG21 ' SD ' ' A' ' 513' ' ' MET . 95.2 t -106.46 122.12 59.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.887 0 CA-C-N 114.901 -1.045 . . . . 73.23 108.563 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 519' ' ' GLU . . . . . 0.474 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 39.3 tt0 -99.2 114.35 27.1 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 108.434 -0.95 . . . . 71.21 108.434 -178.139 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 92.6 t -104.87 136.09 40.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 CA-C-N 114.998 -1.001 . . . . 62.01 109.777 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -135.29 141.86 45.76 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.514 -0.921 . . . . 72.01 108.514 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -76.66 154.69 34.03 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 109.452 -0.573 . . . . 72.33 109.452 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.8 m -152.36 169.28 22.92 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.291 0.567 . . . . 75.32 109.535 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 76.4 p -104.35 164.92 11.4 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 108.178 -1.045 . . . . 72.14 108.178 176.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -54.71 -39.06 67.8 Favored 'General case' 0 C--N 1.307 -1.265 0 O-C-N 123.734 0.646 . . . . 73.44 110.363 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -62.93 -47.19 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.949 -0.569 . . . . 71.12 110.567 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -63.21 -37.16 86.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.374 -0.376 . . . . 73.34 111.446 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 528' ' ' MET . . . . . 0.42 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.3 ttt -62.79 -48.37 79.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.923 -0.58 . . . . 51.41 110.314 177.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -68.36 -34.68 76.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.3 0.571 . . . . 73.14 109.994 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.29 -41.51 96.84 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.26 -0.882 . . . . 74.13 110.906 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 62.7 t -75.98 -35.0 28.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 C-N-CA 119.709 -0.796 . . . . 63.01 110.293 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 528' ' ' MET . 91.4 mt . . . . . 0 C--O 1.241 0.653 0 CA-C-N 116.318 -0.401 . . . . 70.52 111.483 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.246 0.893 0 N-CA-C 107.692 -1.225 . . . . 75.13 107.692 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.588 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 63.7 mtm180 -85.12 66.96 10.01 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.822 0.82 . . . . 71.32 110.735 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -106.41 7.64 31.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.031 -0.986 . . . . 71.13 111.179 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.477 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 18.4 m -106.24 137.08 44.83 Favored 'General case' 0 N--CA 1.416 -2.142 0 C-N-CA 119.445 -0.902 . . . . 74.34 108.874 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -115.54 132.57 64.53 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.265 0 N-CA-C 107.557 -1.275 . . . . 55.22 107.557 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.29 125.56 50.65 Favored 'General case' 0 C--N 1.274 -2.716 0 N-CA-C 108.213 -1.032 . . . . 74.54 108.213 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 17.7 mt -105.33 143.65 33.21 Favored 'General case' 0 C--N 1.275 -2.646 0 N-CA-C 105.913 -1.884 . . . . 75.51 105.913 178.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 450' ' ' ARG . . . . . 0.417 ' HD3' ' OE1' ' A' ' 519' ' ' GLU . 49.2 ttt180 -152.62 141.28 20.9 Favored 'General case' 0 C--N 1.289 -2.023 0 C-N-CA 120.907 -0.317 . . . . 74.12 110.16 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 85.05 23.6 48.24 Favored Glycine 0 C--N 1.311 -0.827 0 N-CA-C 110.615 -0.994 . . . . 71.14 110.615 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.08 151.07 67.8 Favored Pre-proline 0 C--O 1.244 0.776 0 C-N-CA 123.974 0.91 . . . . 71.21 112.998 -176.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -61.45 151.91 76.53 Favored 'Trans proline' 0 N--CA 1.442 -1.509 0 C-N-CA 122.853 2.369 . . . . 72.22 110.642 173.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -77.68 92.23 4.11 Favored 'General case' 0 C--N 1.275 -2.634 0 CA-C-N 114.817 -1.083 . . . . 73.4 110.035 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.22 36.07 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.022 0 CA-C-N 112.226 -2.261 . . . . 43.41 112.456 174.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.66 124.49 19.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 107.717 -1.216 . . . . 65.44 107.717 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 8.6 p -76.13 150.27 37.24 Favored 'General case' 0 N--CA 1.399 -3.012 0 N-CA-C 109.123 -0.695 . . . . 65.43 109.123 -175.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.276 2.4 pp -61.7 -30.73 48.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 114.277 1.214 . . . . 70.43 114.277 -173.133 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 459' ' ' GLU . . . . . 0.432 ' N ' HD12 ' A' ' 458' ' ' ILE . 0.0 OUTLIER -81.56 -22.27 37.91 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.542 -0.863 . . . . 72.41 110.04 -177.7 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 460' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 20.6 t70 -75.67 -40.23 56.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.162 -0.926 . . . . 75.0 109.177 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 13.7 tt -76.0 -32.28 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 115.214 -0.903 . . . . 71.21 110.263 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 84.4 mt -72.14 -29.42 64.03 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.348 -0.612 . . . . 75.13 109.348 176.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 463' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 25.8 t70 -63.16 -53.39 54.1 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-N 115.324 -0.853 . . . . 61.43 108.784 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.81 -42.04 64.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 114.539 -1.21 . . . . 73.23 111.435 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.94 -37.16 78.7 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.828 -0.624 . . . . 53.32 110.982 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 77.36 -140.56 24.68 Favored Glycine 0 N--CA 1.421 -2.32 0 C-N-CA 120.42 -0.895 . . . . 71.12 112.153 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -48.63 -32.08 7.69 Favored 'General case' 0 C--N 1.291 -1.971 0 C-N-CA 126.238 1.815 . . . . 61.43 113.137 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -66.61 -23.44 66.18 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.965 0.412 . . . . 74.42 111.393 -177.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.93 -15.48 60.69 Favored 'General case' 0 C--O 1.206 -1.201 0 CA-C-N 116.136 -0.484 . . . . 63.44 111.532 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.8 m -78.08 -16.83 57.67 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-O 121.389 0.614 . . . . 75.32 110.387 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' ASP . . . . . 0.419 ' OD1' ' HB3' ' A' ' 495' ' ' MET . 11.7 t70 -84.69 -11.9 54.94 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 116.274 -0.421 . . . . 73.43 111.431 -175.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 472' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.1 tt -52.39 145.78 2.53 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 124.194 0.998 . . . . 71.12 111.889 -176.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 473' ' ' ARG . . . . . 0.423 ' O ' HG12 ' A' ' 472' ' ' ILE . 84.8 mtt180 -75.46 158.06 33.16 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.066 -1.087 . . . . 73.25 108.066 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 7.7 t -57.82 110.45 0.91 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-O 121.416 0.627 . . . . 72.21 111.065 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 62.29 27.01 16.18 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.57 1.148 . . . . 75.4 111.088 -176.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.63 19.11 2.06 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 115.276 0.87 . . . . 54.3 115.276 -176.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.5 p -93.61 110.6 23.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-O 121.536 0.684 . . . . 72.41 109.714 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -108.85 94.91 5.3 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.571 -1.27 . . . . 71.15 107.571 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 479' ' ' MET . . . . . 0.544 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 53.6 ttm -87.67 139.31 30.66 Favored 'General case' 0 C--N 1.287 -2.133 0 C-N-CA 120.394 -0.522 . . . . 53.41 109.73 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 66.3 t -81.67 97.85 3.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 N-CA-C 108.826 -0.805 . . . . 74.14 108.826 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.4 mt -97.26 154.02 17.67 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.369 -1.287 . . . . 73.51 107.83 178.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -93.32 173.44 7.71 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.391 -1.707 . . . . 74.34 106.391 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -59.35 -27.51 66.0 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 119.279 0.945 . . . . 74.11 111.724 -176.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -70.37 -11.84 61.18 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.746 0.819 . . . . 75.22 111.155 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 82.5 29.03 37.39 Favored Glycine 0 N--CA 1.432 -1.6 0 CA-C-N 116.131 -0.486 . . . . 32.43 112.412 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -123.1 140.24 33.18 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 108.437 -0.949 . . . . 71.45 108.437 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' PRO . . . . . 0.544 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 29.7 Cg_endo -63.51 134.23 43.63 Favored 'Trans proline' 0 C--O 1.242 0.707 0 C-N-CA 122.906 2.404 . . . . 64.03 113.727 -177.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 17.7 m -76.31 -18.58 58.88 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.735 0.779 . . . . 64.24 109.796 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 106.7 15.85 15.75 Favored Glycine 0 CA--C 1.497 -1.084 0 N-CA-C 111.172 -0.771 . . . . 71.53 111.172 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -127.42 151.85 48.28 Favored 'General case' 0 C--O 1.256 1.433 0 N-CA-C 105.412 -2.07 . . . . 61.35 105.412 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -165.21 153.95 12.09 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 118.153 0.433 . . . . 51.52 110.062 -177.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -125.69 120.13 29.85 Favored 'General case' 0 C--N 1.288 -2.101 0 N-CA-C 108.669 -0.863 . . . . 75.11 108.669 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 56.7 mt -107.66 130.18 60.42 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.53 0 N-CA-C 107.059 -1.459 . . . . 61.45 107.059 176.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' GLN . . . . . 0.477 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 9.3 tt0 -104.5 116.98 33.04 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.155 0.503 . . . . 75.41 110.155 -177.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.419 ' HB3' ' OD1' ' A' ' 471' ' ' ASP . 0.3 OUTLIER -92.79 172.59 8.25 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.197 -0.91 . . . . 72.22 110.192 178.09 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.407 ' HG2' ' HG2' ' A' ' 473' ' ' ARG . 36.0 mtmm -88.16 -35.28 17.49 Favored 'General case' 0 N--CA 1.394 -3.253 0 CA-C-N 116.21 -0.45 . . . . 72.21 110.472 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.4 m -116.25 141.12 48.56 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-O 121.526 0.679 . . . . 44.1 112.085 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -73.03 -16.12 61.5 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.202 -0.908 . . . . 70.44 110.969 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -62.03 -56.38 19.57 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.654 -0.703 . . . . 75.21 109.686 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.27 70.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.082 -0.963 . . . . 71.01 111.243 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.17 -42.76 83.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.11 -0.496 . . . . 72.22 110.71 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -66.69 -44.48 81.62 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.072 0.463 . . . . 73.41 110.287 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 38.5 tpp -71.14 -33.32 69.96 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.75 -0.659 . . . . 74.5 110.991 -175.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.36 -40.55 81.43 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 109.647 -0.501 . . . . 71.11 109.647 176.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -69.41 -30.19 68.09 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.962 -0.563 . . . . 62.02 111.537 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -76.34 -40.78 50.4 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 120.811 -0.356 . . . . 74.24 110.509 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -69.88 -43.3 72.1 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.278 0.561 . . . . 55.41 110.63 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 61.0 m -99.35 16.75 22.03 Favored 'General case' 0 N--CA 1.415 -2.201 0 N-CA-C 113.529 0.937 . . . . 44.05 113.529 -173.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 509' ' ' HIS . . . . . 0.425 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 10.9 t-80 -66.68 91.76 0.2 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.303 -0.559 . . . . 75.01 110.158 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 99.4 mttt 67.93 35.74 3.69 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 125.037 1.335 . . . . 52.14 110.758 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -80.35 147.77 30.93 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.614 -1.175 . . . . 74.13 109.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.49 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 13.8 m120 -74.72 120.3 20.08 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 115.724 -0.671 . . . . 74.25 110.311 178.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.1 ttt -102.15 93.16 5.08 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 106.088 -1.819 . . . . 74.14 106.088 175.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 67.71 -77.38 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 124.297 1.039 . . . . 73.14 111.185 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -125.38 -18.49 5.31 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-O 121.811 0.815 . . . . 74.42 110.713 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 22.7 tpt180 -90.79 160.86 15.56 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.253 -0.885 . . . . 75.42 109.956 -170.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -113.91 116.26 28.99 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.29 -1.744 . . . . 74.54 106.29 172.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 92.9 t -110.86 122.0 64.57 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.921 0 CA-C-N 116.33 -0.396 . . . . 63.42 109.946 -176.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' GLU . . . . . 0.417 ' OE1' ' HD3' ' A' ' 450' ' ' ARG . 41.7 tt0 -85.71 109.46 18.63 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 107.891 -1.151 . . . . 75.23 107.891 176.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 520' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' A' ' 505' ' ' ALA . 97.5 t -105.02 124.65 59.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.295 -1.372 . . . . 52.11 107.295 176.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -133.4 138.28 46.2 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.44 -0.948 . . . . 51.11 108.44 -173.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 522' ' ' GLN . . . . . 0.415 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 46.4 tt0 -83.16 153.25 24.88 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.626 -0.509 . . . . 73.41 109.626 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 523' ' ' CYS . . . . . 0.415 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 5.9 p -162.66 171.5 16.79 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 122.769 0.428 . . . . 74.42 110.004 -177.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.588 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 1.3 m -97.59 160.47 14.3 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.7 -0.682 . . . . 73.35 109.429 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.88 -21.71 61.38 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.629 -0.714 . . . . 71.42 111.535 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.39 -54.1 23.46 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 116.343 -0.39 . . . . 72.03 110.372 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -38.51 82.7 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 110.215 -0.291 . . . . 75.31 110.215 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -59.35 -44.77 92.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.857 -0.61 . . . . 72.41 110.445 177.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -69.32 -40.67 77.49 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.315 0.579 . . . . 71.53 109.567 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -59.62 -44.53 93.42 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.221 -0.899 . . . . 54.31 111.271 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.4 t -73.65 -34.6 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 120.38 -0.528 . . . . 61.04 110.377 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 79.3 mt . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 74.33 111.443 178.836 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.241 0.647 0 N-CA-C 109.672 -0.492 . . . . 72.22 109.672 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.538 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 19.8 ptt85 -92.35 65.72 4.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.168 0.985 . . . . 74.22 111.401 177.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 33.2 p30 -112.75 12.11 19.55 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.294 -0.866 . . . . 74.41 110.408 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 30.7 m -109.18 145.77 35.25 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 108.752 -0.833 . . . . 62.13 108.752 -177.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.72 140.07 49.99 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.111 0 N-CA-C 108.248 -1.019 . . . . 55.25 108.248 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -111.6 121.69 45.83 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.07 -1.085 . . . . 70.41 108.07 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.9 mt -103.41 132.18 49.88 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 106.488 -1.671 . . . . 75.43 106.488 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -126.86 136.61 52.58 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 118.419 0.554 . . . . 55.35 109.621 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 451' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 516' ' ' ARG . . . 96.09 38.86 4.46 Favored Glycine 0 C--N 1.31 -0.885 0 C-N-CA 120.489 -0.862 . . . . 41.22 111.654 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.1 mt -83.54 144.33 45.78 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.991 -0.374 . . . . 70.44 109.991 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 453' ' ' PRO . . . . . 0.472 ' HB2' ' HB2' ' A' ' 456' ' ' ALA . 31.8 Cg_exo -50.15 143.96 24.0 Favored 'Trans proline' 0 C--O 1.253 1.266 0 C-N-CA 123.113 2.542 . . . . 62.53 111.065 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -70.88 92.6 0.92 Allowed 'General case' 0 N--CA 1.417 -2.081 0 CA-C-O 122.402 1.096 . . . . 74.14 111.469 -177.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.87 33.62 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 111.162 -2.744 . . . . 33.13 112.415 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 456' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 453' ' ' PRO . . . -56.01 138.42 49.16 Favored 'General case' 0 C--O 1.246 0.883 0 N-CA-C 109.44 -0.578 . . . . 40.44 109.44 171.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 28.4 p -78.06 160.22 28.23 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 116.42 -0.354 . . . . 63.42 111.02 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.472 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 65.4 mt -65.34 -31.93 56.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.262 0.554 . . . . 63.1 109.601 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -64.01 -40.2 95.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.052 0.453 . . . . 54.31 110.249 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -70.16 -37.83 75.29 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.428 -0.806 . . . . 73.11 110.161 -176.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.421 HG22 ' HA ' ' A' ' 458' ' ' ILE . 13.4 tt -74.59 -32.01 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.027 -0.533 . . . . 75.11 110.651 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -67.31 -35.38 79.32 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.451 0.643 . . . . 53.43 110.001 176.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -65.13 -49.02 71.51 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.621 -0.881 . . . . 64.35 108.621 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -53.73 -41.92 67.58 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 113.894 -1.503 . . . . 75.13 111.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.88 -36.68 84.72 Favored 'General case' 0 C--O 1.248 0.998 0 CA-C-N 116.129 -0.487 . . . . 74.43 111.718 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 84.11 -143.18 21.06 Favored Glycine 0 N--CA 1.422 -2.29 0 C-N-CA 120.099 -1.048 . . . . 61.21 111.706 -178.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -54.52 -34.27 61.43 Favored 'General case' 0 C--N 1.3 -1.561 0 C-N-CA 123.527 0.731 . . . . 65.22 111.066 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' PHE . . . . . 0.411 ' O ' ' HE1' ' A' ' 495' ' ' MET . 95.0 m-85 -61.3 -17.45 53.71 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.559 -0.746 . . . . 73.14 112.599 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 469' ' ' ALA . . . . . 0.473 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -68.25 -15.29 63.52 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 120.836 0.35 . . . . 52.34 111.397 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 17.3 m -84.77 -20.53 30.88 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-O 121.894 0.854 . . . . 52.45 109.194 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -107.43 15.52 24.8 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.362 -0.835 . . . . 70.04 112.365 -174.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 472' ' ' ILE . . . . . 0.473 HG22 ' O ' ' A' ' 469' ' ' ALA . 11.6 tt -82.55 151.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 106.316 -1.735 . . . . 65.0 106.316 170.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 20.8 mtm-85 -100.3 153.76 19.04 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 118.975 -1.09 . . . . 61.14 111.128 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 10.0 t -62.58 136.27 57.81 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.566 -0.901 . . . . 71.23 108.566 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 67.9 22.83 8.54 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 122.294 1.045 . . . . 72.22 109.376 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -88.08 -20.46 49.54 Favored Glycine 0 N--CA 1.423 -2.224 0 C-N-CA 120.701 -0.762 . . . . 62.52 112.853 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 47.8 t -89.66 115.19 28.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 117.011 0.406 . . . . 63.21 110.988 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -127.65 98.09 5.08 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.881 -0.785 . . . . 75.22 108.881 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 86.0 mtp -83.9 139.44 32.61 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.849 -0.426 . . . . 62.21 109.849 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 43.0 t -84.04 97.98 5.33 Favored 'Isoleucine or valine' 0 C--O 1.251 1.171 0 CA-C-O 121.553 0.692 . . . . 71.14 109.728 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 65.2 mt -86.14 155.95 20.55 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.885 -1.154 . . . . 71.52 107.885 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -96.26 -178.67 4.39 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.583 -1.636 . . . . 72.33 106.583 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 47.5 m-70 -65.62 -9.81 30.21 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 119.022 0.828 . . . . 74.34 112.235 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' GLN . . . . . 0.436 ' OE1' ' HD3' ' A' ' 486' ' ' ARG . 35.2 tt0 -81.38 -12.79 58.86 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 123.855 0.862 . . . . 53.44 108.877 176.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 75.33 29.19 60.49 Favored Glycine 0 CA--C 1.494 -1.242 0 CA-C-N 115.275 -0.875 . . . . 62.33 111.373 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.436 ' HD3' ' OE1' ' A' ' 484' ' ' GLN . 62.1 mtp85 -133.16 147.96 67.29 Favored Pre-proline 0 C--N 1.308 -1.238 0 N-CA-C 107.945 -1.132 . . . . 63.23 107.945 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -54.93 134.47 63.57 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 123.734 2.956 . . . . 53.14 115.061 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.7 m -75.48 -33.98 60.86 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.176 -0.92 . . . . 31.43 108.884 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 137.16 -16.35 3.66 Favored Glycine 0 CA--C 1.493 -1.309 0 N-CA-C 110.806 -0.917 . . . . 54.21 110.806 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -116.4 158.7 23.09 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-O 121.021 0.439 . . . . 63.25 110.554 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.33 167.69 29.54 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.687 -0.688 . . . . 55.03 109.53 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -120.08 145.2 47.1 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.064 -0.717 . . . . 72.34 109.064 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 46.5 mt -133.44 131.89 57.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 N-CA-C 107.665 -1.235 . . . . 74.24 107.665 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -106.47 124.47 49.65 Favored 'General case' 0 C--N 1.284 -2.269 0 CA-C-O 121.477 0.655 . . . . 74.45 109.997 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.411 ' HE1' ' O ' ' A' ' 468' ' ' PHE . 96.3 mmm -98.08 170.05 9.18 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.79 -1.095 . . . . 72.11 110.994 -175.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -65.3 -46.39 80.58 Favored 'General case' 0 C--N 1.28 -2.432 0 C-N-CA 125.894 1.678 . . . . 55.22 111.738 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.7 m -130.22 142.61 50.55 Favored 'General case' 0 N--CA 1.408 -2.545 0 N-CA-C 108.617 -0.883 . . . . 55.14 108.617 -172.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.83 74.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.97 0.89 . . . . 75.12 111.126 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.84 -46.1 66.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 114.294 -1.321 . . . . 74.24 110.17 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -62.28 -38.26 88.66 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.821 -1.081 . . . . 72.21 110.293 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.34 -37.93 88.59 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.393 -0.821 . . . . 41.23 111.204 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.71 -41.46 83.51 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 110.045 -0.354 . . . . 61.22 110.045 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 54.8 ttm -67.81 -38.93 83.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.301 -0.408 . . . . 62.2 110.224 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.23 86.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.97 -0.559 . . . . 64.43 110.354 177.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.03 84.32 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.979 -0.555 . . . . 54.34 110.894 177.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -64.83 -42.09 95.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.702 -0.481 . . . . 74.12 109.702 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.05 -45.29 94.2 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.411 0.624 . . . . 65.51 111.105 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.7 m -94.45 6.75 47.81 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 112.848 0.684 . . . . 61.12 112.848 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -76.05 108.35 8.9 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.342 -0.849 . . . . 71.11 108.792 175.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.433 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 44.0 mttp 72.8 17.32 4.39 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.233 1.013 . . . . 64.35 112.066 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.17 138.27 36.84 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 115.894 -0.593 . . . . 73.34 109.801 -178.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -76.11 136.08 39.85 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 115.038 -0.983 . . . . 63.34 111.994 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.4 ttt -129.8 103.25 6.7 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 105.519 -2.03 . . . . 73.25 105.519 175.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 71.3 -78.89 0.04 OUTLIER 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.708 1.203 . . . . 63.21 110.698 -175.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -138.63 -14.79 1.23 Allowed 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.579 0.704 . . . . 64.01 111.843 176.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 516' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 451' ' ' GLY . 0.4 OUTLIER -92.23 156.46 17.28 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.891 -1.151 . . . . 64.53 107.891 -175.22 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -109.66 118.84 37.62 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-O 121.492 0.663 . . . . 73.02 109.321 173.027 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.9 t -92.35 131.23 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.262 0 N-CA-C 107.855 -1.165 . . . . 73.32 107.855 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 519' ' ' GLU . . . . . 0.433 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 42.7 mt-10 -104.94 113.6 27.3 Favored 'General case' 0 N--CA 1.413 -2.31 0 N-CA-C 108.997 -0.742 . . . . 72.22 108.997 175.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 76.0 t -104.08 129.77 55.78 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.606 -1.179 . . . . 71.41 111.196 -177.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -127.57 141.94 51.5 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.281 -0.872 . . . . 73.43 109.076 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -84.0 151.92 24.73 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 117.958 0.345 . . . . 73.22 111.509 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.4 p -155.31 173.23 16.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 123.621 0.768 . . . . 62.53 109.746 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.5 p -102.13 159.59 15.25 Favored 'General case' 0 C--N 1.284 -2.266 0 N-CA-C 112.705 0.631 . . . . 71.41 112.705 -179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.34 -37.62 67.69 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 123.871 0.869 . . . . 41.33 112.086 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.94 -35.64 81.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.997 -0.547 . . . . 75.15 110.713 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.73 -39.77 84.25 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 123.345 0.403 . . . . 61.11 110.568 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 528' ' ' MET . . . . . 0.544 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 42.6 ttm -59.58 -48.45 81.6 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.181 -0.674 . . . . 55.4 109.181 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.38 -35.49 80.56 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.069 -0.969 . . . . 74.44 110.203 -179.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -65.76 -42.3 91.02 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.657 -0.701 . . . . 54.41 110.153 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 88.1 t -72.58 -34.14 46.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 120.932 0.396 . . . . 71.24 110.5 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.9 mt . . . . . 0 CA--C 1.534 0.346 0 CA-C-O 121.187 0.518 . . . . 50.14 110.061 176.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.244 0.778 0 N-CA-C 108.536 -0.913 . . . . 62.41 108.536 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.597 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 26.7 mtp180 -90.82 73.8 6.57 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-O 121.846 0.832 . . . . 75.43 109.72 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 26.4 p-10 -114.68 14.06 17.48 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 115.011 -0.995 . . . . 71.25 109.87 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 25.4 m -116.3 149.66 38.91 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 107.628 -1.249 . . . . 75.33 107.628 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 447' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -124.34 139.33 50.98 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.449 0 N-CA-C 108.935 -0.765 . . . . 63.53 108.935 -177.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -109.97 123.49 49.75 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.083 -1.081 . . . . 64.21 108.083 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 18.2 mt -99.83 144.36 28.98 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 106.979 -1.489 . . . . 73.24 106.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -141.28 140.0 33.79 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.545 -0.909 . . . . 72.34 108.545 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 84.06 32.03 24.46 Favored Glycine 0 C--N 1.291 -1.948 0 C-N-CA 120.315 -0.945 . . . . 74.53 111.727 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.1 138.35 89.75 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 115.981 -0.109 . . . . 74.01 110.852 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -58.25 144.97 94.95 Favored 'Trans proline' 0 CA--C 1.486 -1.914 0 C-N-CA 122.549 2.166 . . . . 73.52 111.31 176.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -78.14 106.69 10.19 Favored 'General case' 1 N--CA 1.376 -4.144 0 N-CA-C 106.908 -1.516 . . . . 73.32 106.908 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.97 29.61 0.02 OUTLIER 'General case' 0 C--N 1.267 -2.986 0 CA-C-N 111.91 -2.404 . . . . 62.15 112.841 173.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -87.3 120.03 28.17 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.317 -1.364 . . . . 64.11 107.317 169.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 457' ' ' THR . . . . . 0.581 ' HB ' ' OE1' ' A' ' 459' ' ' GLU . 20.1 p -74.39 157.24 36.02 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.389 0.138 . . . . 64.53 110.917 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.564 ' HA ' HG22 ' A' ' 461' ' ' ILE . 2.7 pp -65.34 -25.0 36.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 CA-C-O 121.19 0.519 . . . . 73.12 112.093 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 459' ' ' GLU . . . . . 0.581 ' OE1' ' HB ' ' A' ' 457' ' ' THR . 6.3 mp0 -68.21 -33.75 74.98 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.01 -0.737 . . . . 54.44 109.01 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -77.18 -34.1 56.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.21 -0.905 . . . . 50.14 109.646 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.564 HG22 ' HA ' ' A' ' 458' ' ' ILE . 13.4 tt -78.74 -32.2 15.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.983 0 C-N-CA 120.092 -0.643 . . . . 73.34 111.062 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.82 -30.82 71.1 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.939 -0.476 . . . . 72.22 110.866 175.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -63.79 -53.28 53.35 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.944 -1.132 . . . . 61.23 107.944 172.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 461' ' ' ILE . 80.1 t80 -51.92 -41.97 62.41 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 113.297 -1.774 . . . . 72.1 111.727 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 465' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 91.3 mt -64.65 -37.3 87.12 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.725 -0.67 . . . . 75.12 111.565 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 90.4 -141.85 16.08 Favored Glycine 0 N--CA 1.419 -2.496 0 C-N-CA 120.255 -0.974 . . . . 41.51 112.253 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.56 -27.88 12.26 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 124.852 1.261 . . . . 62.32 112.186 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -64.63 -13.53 54.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.591 . . . . 71.44 112.418 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -67.36 -19.92 65.49 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.105 0.478 . . . . 72.02 111.176 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.2 m -101.71 0.46 36.04 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-O 121.968 0.89 . . . . 63.02 109.811 176.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' ASP . . . . . 0.424 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 58.6 m-20 -108.56 6.14 25.72 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 121.816 -0.552 . . . . 63.1 112.333 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 472' ' ' ILE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 495' ' ' MET . 7.6 tt -88.74 151.71 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.791 0 N-CA-C 107.61 -1.256 . . . . 43.31 107.61 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 42.5 ptt85 -78.02 161.88 27.15 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 118.48 -1.288 . . . . 63.3 109.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 32.7 m -66.69 115.87 6.99 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 115.589 -0.732 . . . . 74.31 110.483 -175.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 65.44 28.81 11.55 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.616 1.166 . . . . 74.32 109.741 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -80.0 8.22 52.01 Favored Glycine 0 N--CA 1.442 -0.902 0 CA-C-N 115.448 -0.796 . . . . 62.33 114.392 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.96 118.85 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.812 -0.811 . . . . 41.35 108.812 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -117.18 135.35 53.84 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 107.34 -1.356 . . . . 65.2 107.34 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 52.7 tpp -116.05 138.52 51.15 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 108.861 -0.792 . . . . 62.22 108.861 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.05 106.01 16.03 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.128 0 N-CA-C 108.327 -0.99 . . . . 43.45 108.327 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 60.1 mt -89.8 147.39 23.83 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 106.344 -1.725 . . . . 73.33 106.344 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -90.33 -169.38 2.39 Favored 'General case' 0 C--N 1.27 -2.882 0 CA-C-N 115.919 -0.582 . . . . 51.3 109.915 -176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -62.64 -29.06 70.34 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.526 0.679 . . . . 60.13 110.362 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -79.99 -7.0 58.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.542 -0.753 . . . . 74.31 110.55 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 485' ' ' GLY . . . . . 0.456 ' C ' ' HD2' ' A' ' 486' ' ' ARG . . . 79.36 21.88 66.22 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 116.263 -0.426 . . . . 71.03 113.075 176.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.456 ' HD2' ' C ' ' A' ' 485' ' ' GLY . 8.5 mpt_? -120.31 151.32 53.29 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 108.667 -0.864 . . . . 71.45 108.667 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.15 123.38 13.7 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.467 2.112 . . . . 72.31 112.574 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 13.0 m -74.92 -8.35 56.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.689 -0.687 . . . . 71.33 111.004 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 87.74 16.43 59.92 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.368 -1.093 . . . . 42.41 110.368 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -125.56 132.78 52.5 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 103.968 -2.605 . . . . 54.22 103.968 -178.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -148.56 167.08 26.34 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 118.381 0.537 . . . . 53.5 110.42 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 85.4 m-85 -135.48 120.59 18.82 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 123.231 0.612 . . . . 74.33 109.606 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.4 mt -110.54 131.96 60.23 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 108.054 -1.091 . . . . 71.14 108.054 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -103.91 124.78 49.59 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 108.568 -0.901 . . . . 71.13 108.568 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.417 ' HA ' ' HA ' ' A' ' 472' ' ' ILE . 91.1 mmm -98.7 175.05 6.12 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.272 0.558 . . . . 73.25 111.304 -174.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -71.8 -34.77 69.66 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 124.933 1.293 . . . . 60.42 110.55 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 30.6 t -152.18 153.59 34.14 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 115.007 -0.997 . . . . 75.25 109.962 -172.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.2 75.36 Favored 'General case' 0 CA--C 1.508 -0.673 0 C-N-CA 123.814 0.846 . . . . 71.43 110.815 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -59.09 -48.23 82.37 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 122.488 1.137 . . . . 61.43 109.959 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' ARG . . . . . 0.424 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 1.5 mmp_? -65.7 -40.98 92.86 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 113.227 -1.806 . . . . 74.34 109.832 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.97 -40.99 87.59 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.281 -0.872 . . . . 73.32 110.581 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -66.12 -38.35 87.97 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.647 -0.706 . . . . 74.02 110.93 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 83.8 mtp -75.63 -36.31 60.24 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 119.482 -0.887 . . . . 64.02 110.965 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.22 -41.1 90.56 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.283 -0.417 . . . . 75.22 110.596 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.76 -36.18 80.06 Favored 'General case' 0 C--O 1.203 -1.371 0 CA-C-N 116.067 -0.515 . . . . 55.24 110.38 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -44.72 82.06 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.477 -0.329 . . . . 75.14 110.898 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -63.45 -43.55 97.07 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.668 0.605 . . . . 73.21 111.369 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.8 m -101.67 10.99 39.6 Favored 'General case' 0 N--CA 1.432 -1.354 0 N-CA-C 112.726 0.639 . . . . 54.05 112.726 -173.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 509' ' ' HIS . . . . . 0.47 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 44.0 t60 -70.4 97.56 1.29 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 119.853 -0.739 . . . . 75.33 109.206 176.044 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 66.4 66.24 0.47 Allowed 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 125.156 1.383 . . . . 74.12 110.203 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.3 tptt -112.79 140.81 47.26 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.323 -1.762 . . . . 72.43 108.818 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -86.32 132.46 33.97 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 120.211 -0.596 . . . . 72.41 110.596 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.3 ttt -118.26 88.66 2.96 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 106.13 -1.804 . . . . 72.21 106.13 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt 68.99 -83.52 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.059 -1.428 . . . . 74.01 113.01 -176.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -121.87 -9.77 8.76 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.393 0.616 . . . . 70.13 110.833 -173.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -115.24 156.65 24.99 Favored 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 108.518 -0.919 . . . . 71.45 108.518 -173.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -108.85 121.45 45.11 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 121.112 0.482 . . . . 73.13 109.787 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' VAL . . . . . 0.425 HG12 HG23 ' A' ' 520' ' ' VAL . 60.5 t -102.9 114.04 41.34 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.951 0 CA-C-N 114.53 -1.214 . . . . 74.43 108.153 -178.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -104.51 110.37 22.62 Favored 'General case' 0 C--N 1.279 -2.497 0 N-CA-C 107.625 -1.25 . . . . 65.42 107.625 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 520' ' ' VAL . . . . . 0.425 HG23 HG12 ' A' ' 518' ' ' VAL . 73.5 t -104.82 129.02 58.04 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 CA-C-N 115.709 -0.678 . . . . 63.42 111.336 -175.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -116.06 152.11 34.23 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.325 -0.991 . . . . 75.32 108.325 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -90.99 157.81 17.07 Favored 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 106.835 -1.542 . . . . 74.01 106.835 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -157.69 160.51 38.03 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.405 0.622 . . . . 71.42 112.422 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.597 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 38.1 t -86.09 150.83 24.16 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.727 -1.124 . . . . 71.4 109.037 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.01 -30.03 67.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.208 0.528 . . . . 72.44 110.189 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -65.85 -51.47 58.6 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.56 1.144 . . . . 75.13 109.572 176.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -64.81 -37.48 87.76 Favored 'General case' 0 C--N 1.297 -1.69 0 C-N-CA 126.067 1.747 . . . . 72.25 109.798 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 528' ' ' MET . . . . . 0.441 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.2 ttt -67.03 -44.63 79.76 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.315 -0.857 . . . . 70.41 109.566 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -65.57 -38.11 88.6 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.874 -0.603 . . . . 61.43 109.779 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -59.31 -45.88 90.1 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.43 -0.805 . . . . 74.3 110.742 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 60.4 t -68.89 -39.65 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 120.18 -0.608 . . . . 74.51 110.326 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.5 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.489 . . . . 71.14 112.22 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 36.6 t . . . . . 0 C--O 1.249 1.067 0 N-CA-C 107.712 -1.218 . . . . 63.45 107.712 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.57 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.6 mtm180 -88.1 75.76 8.63 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 108.507 -0.923 . . . . 72.44 108.507 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -116.18 11.17 15.12 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.173 -1.376 . . . . 75.4 112.196 -171.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 56.6 m -106.63 152.43 23.76 Favored 'General case' 0 N--CA 1.407 -2.575 0 C-N-CA 119.547 -0.861 . . . . 65.43 109.464 -176.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 447' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -122.26 140.13 47.09 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.109 0 N-CA-C 106.495 -1.669 . . . . 75.35 106.495 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 448' ' ' ARG . . . . . 0.54 ' HD3' ' NH2' ' A' ' 450' ' ' ARG . 20.1 ttm180 -115.4 125.45 53.17 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.052 -0.722 . . . . 61.41 109.052 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 8.7 mt -107.12 145.66 32.22 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 107.647 -1.242 . . . . 62.21 107.647 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 450' ' ' ARG . . . . . 0.54 ' NH2' ' HD3' ' A' ' 448' ' ' ARG . 2.7 ptp180 -149.31 130.81 14.82 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 121.08 0.467 . . . . 75.25 111.706 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 111.02 29.95 3.35 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.407 -0.815 . . . . 25.5 111.094 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 91.4 mt -70.6 133.12 86.93 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 111.665 0.246 . . . . 75.41 111.665 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 453' ' ' PRO . . . . . 0.496 ' HA ' ' CZ ' ' A' ' 516' ' ' ARG . 31.3 Cg_exo -58.58 164.64 9.0 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 123.305 2.67 . . . . 72.35 113.389 175.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -77.47 100.15 5.91 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.964 -1.471 . . . . 70.14 108.179 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.61 32.62 0.02 OUTLIER 'General case' 0 C--N 1.277 -2.544 0 CA-C-N 111.756 -2.475 . . . . 73.12 111.421 173.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.85 113.62 3.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.024 -1.102 . . . . 61.5 108.024 171.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 72.8 p -84.26 170.47 13.67 Favored 'General case' 0 N--CA 1.426 -1.642 0 CA-C-O 120.98 0.419 . . . . 62.05 112.048 -173.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.587 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 35.9 pt -63.68 -24.85 36.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.689 -0.687 . . . . 70.25 110.255 174.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.86 -43.04 37.66 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.254 -0.647 . . . . 72.23 109.254 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' ASP . . . . . 0.535 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 7.9 t70 -69.64 -32.29 70.88 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.286 -0.87 . . . . 74.13 109.845 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.453 HG22 ' HA ' ' A' ' 458' ' ' ILE . 11.7 tt -74.53 -29.02 23.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 C-N-CA 120.293 -0.563 . . . . 73.21 110.288 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 85.6 mt -65.45 -36.06 82.76 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.564 -0.532 . . . . 70.4 109.564 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 463' ' ' ASP . . . . . 0.535 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 22.6 t70 -57.38 -56.23 24.48 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.371 -0.831 . . . . 63.21 109.074 171.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -53.3 -40.47 64.77 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 113.506 -1.679 . . . . 71.25 111.82 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 82.3 mt -73.26 -37.29 66.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.654 -0.703 . . . . 64.55 112.357 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.49 -137.16 39.62 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 119.762 -1.209 . . . . 72.54 112.09 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -57.43 -21.89 39.69 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 124.632 1.173 . . . . 73.43 112.354 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -69.39 -10.14 56.62 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.372 0.508 . . . . 71.22 112.372 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -65.98 -15.22 62.81 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.353 0.597 . . . . 73.23 110.933 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 13.9 m -87.54 -14.87 39.07 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-O 121.115 0.483 . . . . 64.21 111.014 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.2 6.69 20.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.64 0.978 . . . . 64.44 113.64 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 8.9 tt -90.58 151.47 3.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 N-CA-C 108.524 -0.917 . . . . 74.33 108.524 175.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -78.78 148.18 33.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.093 -0.706 . . . . 63.35 109.093 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 29.1 m -51.43 109.97 0.4 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.359 1.064 . . . . 64.34 112.777 -175.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 34.6 m170 64.13 28.68 14.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.509 1.124 . . . . 73.42 110.707 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.42 20.58 8.57 Favored Glycine 0 N--CA 1.43 -1.74 0 CA-C-N 114.986 -1.006 . . . . 42.2 113.453 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.83 106.15 17.57 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 N-CA-C 106.67 -1.604 . . . . 64.42 106.67 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -114.35 93.27 4.27 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 109.153 -0.684 . . . . 74.44 109.153 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' MET . . . . . 0.402 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 1.5 pmm? -83.82 142.68 30.46 Favored 'General case' 0 C--N 1.294 -1.844 0 C-N-CA 120.564 -0.455 . . . . 64.33 109.935 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 57.3 t -76.74 124.92 35.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 106.581 -1.637 . . . . 74.1 106.581 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.23 154.95 18.55 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.16 0.505 . . . . 70.33 109.996 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -96.04 172.02 8.26 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 105.775 -1.935 . . . . 71.33 105.775 176.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -65.51 -5.18 7.22 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.693 0.997 . . . . 65.51 113.693 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' GLN . . . . . 0.472 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 36.2 tt0 -92.56 -1.11 57.17 Favored 'General case' 0 CA--C 1.555 1.17 0 CA-C-O 121.984 0.897 . . . . 70.23 109.25 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.19 30.65 62.56 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.629 -0.714 . . . . 65.14 112.83 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.472 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 93.9 mtt180 -127.81 148.6 67.7 Favored Pre-proline 0 C--N 1.306 -1.287 0 N-CA-C 107.905 -1.146 . . . . 71.44 107.905 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.92 133.45 54.82 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.08 2.52 . . . . 54.42 113.531 -177.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.9 m -73.73 -17.91 61.06 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 123.888 0.875 . . . . 73.1 111.165 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 118.02 -20.14 10.79 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 110.444 -1.062 . . . . 64.12 110.444 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -108.33 148.52 29.94 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 106.543 -1.651 . . . . 63.51 106.543 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.402 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -159.71 171.13 20.1 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 117.903 0.32 . . . . 55.04 110.803 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 492' ' ' PHE . . . . . 0.436 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 98.3 m-85 -128.55 151.08 49.85 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.605 -0.725 . . . . 63.53 109.511 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 50.7 mt -131.14 137.41 55.78 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.737 0 N-CA-C 105.849 -1.908 . . . . 62.55 105.849 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -110.72 115.89 30.35 Favored 'General case' 0 C--N 1.276 -2.622 0 C-N-CA 119.197 -1.001 . . . . 74.24 109.223 177.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.405 ' CG ' ' HB3' ' A' ' 500' ' ' ARG . 3.2 tpt -92.73 167.09 12.11 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.718 -1.128 . . . . 64.34 108.996 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.411 ' HB3' ' HG2' ' A' ' 500' ' ' ARG . 39.7 ttmt -53.24 -45.45 68.75 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.95 1.3 . . . . 75.21 112.295 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 22.6 m -147.65 168.4 22.14 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.282 -0.872 . . . . 61.2 110.0 -173.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.47 93.86 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 123.863 0.727 . . . . 73.53 111.911 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -69.2 -37.69 78.22 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 108.912 -0.773 . . . . 73.43 108.912 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 500' ' ' ARG . . . . . 0.411 ' HG2' ' HB3' ' A' ' 496' ' ' LYS . 0.0 OUTLIER -58.69 -47.75 83.45 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.228 -1.351 . . . . 71.4 110.2 175.268 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -64.02 -39.06 93.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 65.11 110.495 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.75 -44.87 95.07 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.653 -0.703 . . . . 74.21 110.878 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 26.4 ttt -69.0 -37.23 78.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.146 -0.479 . . . . 73.23 110.18 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.99 83.17 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.81 -0.632 . . . . 65.41 110.515 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.85 -38.96 87.38 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.191 -0.458 . . . . 61.24 110.65 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -66.91 -41.4 87.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.12 0.486 . . . . 51.33 109.987 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -64.34 -40.26 95.53 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.578 -0.737 . . . . 72.24 111.36 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 508' ' ' CYS . . . . . 0.401 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 22.9 m -107.86 13.77 26.02 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 113.252 0.834 . . . . 71.23 113.252 -173.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -67.89 98.29 0.73 Allowed 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.884 -0.51 . . . . 73.22 109.714 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 85.8 tttt 66.09 54.5 0.98 Allowed 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.95 1.3 . . . . 72.43 109.604 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 511' ' ' LYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 54.2 tptt -93.26 140.35 29.63 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.701 -1.59 . . . . 60.12 109.023 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -84.7 113.7 21.49 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-O 121.077 0.465 . . . . 75.31 109.815 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 23.9 ttt -94.41 93.3 7.59 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 105.345 -2.094 . . . . 61.44 105.345 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 13.3 mptt 68.1 -82.26 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.871 -1.059 . . . . 72.05 111.333 -173.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -131.77 0.45 3.93 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 112.077 0.399 . . . . 71.42 112.077 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 516' ' ' ARG . . . . . 0.496 ' CZ ' ' HA ' ' A' ' 453' ' ' PRO . 15.8 ttm180 -118.49 146.54 44.44 Favored 'General case' 0 C--N 1.298 -1.671 0 C-N-CA 119.848 -0.741 . . . . 55.41 109.166 -176.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -89.59 120.76 31.17 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 109.111 -0.7 . . . . 74.33 109.111 -177.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 71.2 t -107.39 115.11 47.95 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.825 0 N-CA-C 107.246 -1.391 . . . . 73.41 107.246 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -94.19 112.75 24.59 Favored 'General case' 0 C--N 1.285 -2.21 0 N-CA-C 108.287 -1.005 . . . . 74.21 108.287 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -105.2 128.7 58.89 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.084 0 CA-C-N 115.439 -0.801 . . . . 63.42 110.373 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -128.83 159.55 35.39 Favored 'General case' 0 C--O 1.211 -0.924 0 C-N-CA 123.309 0.643 . . . . 71.05 109.302 -178.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.22 143.92 25.79 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.401 -0.592 . . . . 62.32 109.401 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 7.3 p -141.6 171.1 14.52 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 122.872 0.469 . . . . 53.2 111.4 -177.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.9 m -98.64 144.89 27.43 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 115.698 -0.683 . . . . 74.44 111.261 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 525' ' ' ALA . . . . . 0.408 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -62.84 -31.91 73.02 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.817 0.673 . . . . 75.44 112.817 -177.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.69 -41.12 92.79 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.943 0.402 . . . . 74.14 110.469 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 527' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 531' ' ' VAL . 35.8 tt0 -72.2 -39.03 68.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.394 0.616 . . . . 71.44 109.358 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -62.66 -44.04 97.28 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.1 -0.954 . . . . 73.43 109.71 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.48 -30.29 68.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.198 0.523 . . . . 64.52 110.411 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -65.71 -45.2 83.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.616 -0.72 . . . . 72.42 109.575 178.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 527' ' ' GLU . 58.3 t -67.02 -38.62 81.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.98 -0.555 . . . . 63.22 110.08 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 65.5 mt . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 121.013 0.435 . . . . 75.3 111.487 178.384 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 443' ' ' VAL . . . . . 0.474 ' HB ' ' OD2' ' A' ' 445' ' ' ASP . 25.5 t . . . . . 0 C--O 1.242 0.689 0 N-CA-C 107.273 -1.38 . . . . 73.15 107.273 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.555 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.0 mtp85 -84.63 52.53 2.41 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 122.154 0.978 . . . . 73.42 109.731 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 445' ' ' ASP . . . . . 0.474 ' OD2' ' HB ' ' A' ' 443' ' ' VAL . 3.3 p30 -101.65 2.47 38.79 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.801 -1.091 . . . . 71.11 111.023 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 23.3 m -110.96 141.31 44.58 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 118.869 -1.132 . . . . 40.11 109.012 -174.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -120.62 144.17 30.32 Favored 'Isoleucine or valine' 0 C--N 1.26 -3.318 0 N-CA-C 107.704 -1.221 . . . . 61.2 107.704 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 448' ' ' ARG . . . . . 0.549 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 28.0 ttp180 -119.67 124.97 47.57 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.333 0.587 . . . . 73.01 109.815 173.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 8.6 mt -93.75 133.54 37.02 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 105.907 -1.886 . . . . 75.33 105.907 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 450' ' ' ARG . . . . . 0.453 ' C ' ' HD3' ' A' ' 450' ' ' ARG . 2.0 tmt_? -128.17 130.96 48.87 Favored 'General case' 0 C--N 1.277 -2.586 0 CA-C-O 121.221 0.534 . . . . 74.01 109.667 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 451' ' ' GLY . . . . . 0.438 ' O ' HG22 ' A' ' 518' ' ' VAL . . . 95.48 47.92 2.46 Favored Glycine 0 C--N 1.283 -2.365 0 N-CA-C 110.248 -1.141 . . . . 34.24 110.248 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 83.3 mt -72.63 148.69 90.34 Favored Pre-proline 0 C--N 1.312 -1.035 0 N-CA-C 111.763 0.282 . . . . 73.42 111.763 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.04 179.35 0.8 Allowed 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.701 2.267 . . . . 65.23 111.161 173.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -77.74 87.61 3.99 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 115.527 -0.761 . . . . 72.25 111.631 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 63.88 41.83 6.44 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 113.045 -1.889 . . . . 73.24 111.427 169.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -50.0 125.28 11.71 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 114.999 -1.0 . . . . 71.23 108.414 171.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 1.6 p -72.24 162.46 29.44 Favored 'General case' 0 N--CA 1.419 -1.99 0 N-CA-C 113.409 0.892 . . . . 73.12 113.409 -170.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.462 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.1 pt -60.25 -27.54 39.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 113.871 1.063 . . . . 73.25 113.871 -172.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.77 -26.68 34.25 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.129 -1.028 . . . . 65.51 110.38 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 460' ' ' ASP . . . . . 0.594 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 5.2 t70 -78.34 -28.48 47.24 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.019 -0.537 . . . . 75.14 110.462 -178.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.418 HG22 ' O ' ' A' ' 458' ' ' ILE . 15.4 tt -70.18 -32.04 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 C-N-CA 119.617 -0.833 . . . . 73.1 108.832 175.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 88.3 mt -70.71 -36.07 73.05 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.311 0.577 . . . . 72.32 109.507 176.23 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 463' ' ' ASP . . . . . 0.594 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 6.3 t70 -55.48 -55.96 25.8 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.746 -1.115 . . . . 72.23 108.825 173.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 113.749 -1.569 . . . . 75.15 111.598 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 57.9 mt -67.42 -29.96 69.59 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 113.062 0.764 . . . . 64.24 113.062 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.95 -137.92 26.15 Favored Glycine 0 N--CA 1.425 -2.066 0 C-N-CA 119.161 -1.495 . . . . 14.44 111.72 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -58.09 -28.12 64.3 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.699 -0.75 . . . . 63.22 112.372 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -70.67 -11.2 60.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.24 0.459 . . . . 72.25 112.24 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -64.44 -22.22 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.175 0.805 . . . . 34.44 113.175 -176.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 11.7 t -101.7 -3.15 28.71 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.618 0.723 . . . . 71.03 110.49 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.99 3.27 41.42 Favored 'General case' 0 C--O 1.245 0.841 0 CA-C-O 121.235 0.541 . . . . 72.5 111.319 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 10.4 tt -75.49 148.49 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.287 0 N-CA-C 107.627 -1.249 . . . . 75.23 107.627 173.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 62.2 mtm180 -79.38 164.85 23.7 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 120.113 -0.635 . . . . 75.41 110.967 176.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 8.8 m -52.87 107.12 0.2 Allowed 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.973 0.909 . . . . 71.23 112.128 -174.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 60.88 27.7 17.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.119 0.968 . . . . 64.14 111.629 177.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -72.85 -1.45 55.0 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.106 -0.952 . . . . 43.01 114.576 -176.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.8 p -86.42 115.26 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 CA-C-O 121.866 0.841 . . . . 64.41 109.622 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -124.64 96.77 5.02 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.851 -0.613 . . . . 61.03 109.85 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 479' ' ' MET . . . . . 0.489 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 62.0 mtt -77.75 133.97 38.16 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.477 -0.934 . . . . 73.35 108.477 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 58.5 t -78.12 101.57 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.314 0 N-CA-C 107.551 -1.277 . . . . 61.42 107.551 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 73.8 mt -93.35 156.67 16.65 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-N 115.495 -0.775 . . . . 45.11 110.309 -177.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -103.31 179.76 4.18 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 105.878 -1.897 . . . . 73.24 105.878 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -55.57 -38.72 69.73 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 124.054 0.941 . . . . 54.51 112.424 -174.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -75.93 -1.85 27.52 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.274 0.559 . . . . 74.14 111.941 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 78.69 31.95 42.99 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.783 -0.722 . . . . 45.12 111.898 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -118.01 139.78 27.02 Favored Pre-proline 0 C--N 1.307 -1.264 0 N-CA-C 107.577 -1.268 . . . . 74.05 107.577 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.47 134.17 49.96 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.051 1.834 . . . . 73.3 110.987 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.8 m -75.94 1.87 14.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.647 0.737 . . . . 53.31 110.929 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.71 -30.76 6.23 Favored Glycine 0 CA--C 1.49 -1.481 0 CA-C-N 115.452 -0.794 . . . . 73.31 112.145 175.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' ASP . . . . . 0.479 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.1 p-10 -113.45 149.9 33.56 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-O 121.184 0.516 . . . . 55.12 111.639 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -150.75 155.56 39.52 Favored 'General case' 0 C--O 1.204 -1.31 0 CA-C-N 115.497 -0.774 . . . . 55.3 109.533 -177.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 492' ' ' PHE . . . . . 0.549 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 81.5 m-85 -111.28 146.09 37.62 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-O 121.189 0.519 . . . . 65.15 111.42 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 61.1 mt -126.51 122.13 60.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 106.52 -1.659 . . . . 75.43 106.52 172.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -100.96 114.08 27.65 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 115.633 -0.712 . . . . 64.53 109.907 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 94.9 mmm -92.88 172.94 8.01 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.4 0.619 . . . . 64.14 111.419 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -75.51 -40.47 57.03 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.045 -0.979 . . . . 74.1 110.192 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 41.5 t -140.98 150.81 43.56 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 116.268 -0.423 . . . . 73.4 110.289 -175.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.56 -29.79 70.45 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 123.969 0.908 . . . . 73.41 112.324 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -64.08 -42.84 96.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.868 0.842 . . . . 74.02 109.693 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -68.53 -38.73 81.09 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 114.534 -1.212 . . . . 72.13 110.463 177.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.35 90.81 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.891 -0.595 . . . . 53.02 110.975 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -68.78 -42.26 77.67 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.848 -0.427 . . . . 74.14 109.848 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 51.1 ttm -64.26 -40.91 96.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.987 -0.551 . . . . 74.41 110.486 -177.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.37 -39.95 81.61 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 116.226 -0.443 . . . . 54.13 110.188 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.89 -37.22 81.5 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 116.17 -0.468 . . . . 65.01 111.123 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -65.32 -44.58 87.39 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.944 -0.391 . . . . 54.54 109.944 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -66.09 -39.95 90.4 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.87 -0.605 . . . . 72.33 110.583 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 38.2 m -99.43 12.38 36.53 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 113.259 0.837 . . . . 74.32 113.259 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -70.23 95.69 1.03 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.365 -0.834 . . . . 63.31 109.891 176.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.1 tttt 64.33 62.65 0.81 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.977 1.711 . . . . 75.41 110.056 -177.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -108.14 148.56 29.68 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 112.641 -2.072 . . . . 61.23 108.803 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -77.12 119.87 21.42 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.176 0.512 . . . . 62.45 110.221 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.6 ttt -103.98 80.32 1.73 Allowed 'General case' 0 N--CA 1.404 -2.729 0 N-CA-C 105.584 -2.006 . . . . 61.23 105.584 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 514' ' ' LYS . . . . . 0.501 ' HD2' ' N ' ' A' ' 514' ' ' LYS . 0.1 OUTLIER 68.8 -75.75 0.06 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 113.601 -1.636 . . . . 72.34 112.204 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -106.09 -31.79 8.55 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 113.292 0.849 . . . . 54.55 113.292 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -110.61 157.79 19.3 Favored 'General case' 0 C--N 1.273 -2.719 0 CA-C-N 115.788 -0.642 . . . . 74.31 110.542 -168.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -95.32 126.89 40.94 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.467 -1.679 . . . . 54.51 106.467 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 518' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 451' ' ' GLY . 66.7 t -114.06 120.28 63.42 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.678 0 N-CA-C 108.795 -0.817 . . . . 73.42 108.795 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.83 112.47 22.51 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 107.785 -1.191 . . . . 75.2 107.785 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -103.69 129.68 55.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 109.963 -0.384 . . . . 53.32 109.963 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.662 -0.699 . . . . 74.2 109.244 -177.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 522' ' ' GLN . . . . . 0.465 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 42.0 tt0 -87.63 155.64 19.85 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.038 -1.097 . . . . 63.35 108.038 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 523' ' ' CYS . . . . . 0.465 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 7.9 p -162.05 171.69 17.12 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.461 0.648 . . . . 74.11 110.942 -178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 60.3 p -91.88 155.35 18.25 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.104 -0.953 . . . . 72.44 110.167 177.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.67 -27.82 52.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.316 -0.856 . . . . 71.54 111.433 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.32 -51.87 67.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 55.24 109.168 176.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.7 -37.42 87.27 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.338 -0.846 . . . . 74.23 109.883 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 528' ' ' MET . . . . . 0.456 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 24.8 ttt -61.56 -46.85 88.14 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.695 -0.684 . . . . 74.21 110.848 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -73.4 -28.97 62.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.925 -0.71 . . . . 73.32 109.639 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.33 -47.86 82.36 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 115.739 -0.664 . . . . 72.42 110.231 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.7 t -69.76 -34.54 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 120.826 -0.35 . . . . 75.14 110.276 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.3 mt . . . . . 0 C--N 1.327 -0.392 0 CA-C-O 120.903 0.382 . . . . 71.13 111.094 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 C--O 1.245 0.819 0 N-CA-C 109.465 -0.569 . . . . 74.05 109.465 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.542 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 54.4 mtm180 -80.87 63.78 5.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.805 0.812 . . . . 74.34 109.758 176.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 40.7 p-10 -95.79 4.21 53.08 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 115.31 -0.859 . . . . 64.04 110.012 -175.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.597 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 39.3 m -102.7 149.43 24.45 Favored 'General case' 0 N--CA 1.411 -2.419 0 CA-C-O 121.616 0.722 . . . . 75.21 110.618 -174.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 447' ' ' ILE . . . . . 0.64 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.4 mt -125.46 145.4 32.89 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.738 0 CA-C-N 114.608 -1.178 . . . . 54.53 107.95 178.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -119.83 120.37 36.27 Favored 'General case' 0 N--CA 1.416 -2.161 0 N-CA-C 106.472 -1.677 . . . . 75.2 106.472 172.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 13.0 mt -103.93 131.5 51.1 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 106.741 -1.578 . . . . 75.24 106.741 -178.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -132.82 142.98 49.25 Favored 'General case' 0 C--N 1.257 -3.415 0 N-CA-C 108.497 -0.927 . . . . 71.12 108.497 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 96.4 26.24 11.27 Favored Glycine 0 C--N 1.289 -2.03 0 C-N-CA 120.052 -1.07 . . . . 63.34 110.765 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 64.3 mt -72.95 144.25 85.07 Favored Pre-proline 0 C--N 1.304 -1.376 0 N-CA-C 109.276 -0.638 . . . . 64.51 109.276 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -55.41 161.13 7.75 Favored 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.883 2.389 . . . . 70.51 112.001 175.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -77.35 90.63 3.79 Favored 'General case' 0 N--CA 1.411 -2.417 0 CA-C-N 115.067 -0.97 . . . . 72.04 111.04 -177.037 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.11 29.93 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 112.085 -2.325 . . . . 74.14 112.672 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.15 140.79 52.66 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.3 -1.37 . . . . 74.5 107.3 170.105 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 68.2 p -86.43 174.39 9.02 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 120.345 -0.542 . . . . 72.03 111.709 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.429 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 72.0 mt -63.97 -37.37 79.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 108.998 -0.742 . . . . 74.04 108.998 177.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.15 -37.6 87.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.86 -0.609 . . . . 73.21 109.811 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -65.75 -42.85 90.43 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.806 -0.634 . . . . 65.11 110.706 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 9.3 tp -72.71 -33.39 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 119.98 -0.688 . . . . 71.2 110.681 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -68.88 -32.86 72.83 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.156 0.503 . . . . 63.13 109.668 177.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.77 -52.71 59.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-N 115.127 -0.942 . . . . 51.55 108.766 176.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.26 -41.29 79.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.078 -1.419 . . . . 62.3 111.325 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 67.9 mt -67.78 -32.6 73.29 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.892 -0.594 . . . . 73.2 111.859 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.06 -124.09 7.61 Favored Glycine 0 N--CA 1.418 -2.537 0 C-N-CA 119.377 -1.392 . . . . 63.44 113.129 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -42.58 -42.21 3.31 Favored 'General case' 0 C--N 1.287 -2.146 0 C-N-CA 126.693 1.997 . . . . 72.53 112.625 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -66.16 -12.37 55.43 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.359 -0.837 . . . . 52.03 112.785 -172.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.35 -15.7 60.93 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.406 0.622 . . . . 60.31 110.352 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.5 m -85.23 -28.03 25.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.63 0.729 . . . . 53.23 110.238 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -106.75 15.68 25.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.906 0.86 . . . . 74.02 110.631 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -68.43 142.6 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 N-CA-C 108.856 -0.794 . . . . 62.43 108.856 176.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.15 143.36 33.93 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 106.142 -1.799 . . . . 70.32 106.142 178.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 22.3 m -54.8 106.86 0.24 Allowed 'General case' 0 C--N 1.298 -1.635 0 O-C-N 124.254 0.971 . . . . 75.11 111.944 -172.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 27.0 m170 60.72 35.03 19.79 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.026 0.93 . . . . 73.4 111.729 -177.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -83.41 -0.39 90.02 Favored Glycine 0 N--CA 1.432 -1.625 0 CA-C-N 115.004 -0.998 . . . . 65.12 111.422 175.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 5.5 p -82.06 127.86 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 CA-C-O 121.221 0.534 . . . . 73.4 110.05 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -138.77 96.83 3.2 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.054 -1.091 . . . . 73.14 108.054 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 479' ' ' MET . . . . . 0.507 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 55.4 ttm -78.24 139.75 38.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.366 -0.605 . . . . 74.5 109.366 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 74.7 t -94.29 110.61 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.726 0 CA-C-O 122.105 0.955 . . . . 73.21 111.136 -176.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.47 HD23 ' H ' ' A' ' 481' ' ' LEU . 0.7 OUTLIER -104.59 159.8 15.46 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.189 -1.368 . . . . 70.23 108.142 175.126 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -114.04 -168.97 1.43 Allowed 'General case' 0 C--N 1.273 -2.742 0 N-CA-C 108.435 -0.95 . . . . 72.35 108.435 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 31.9 t60 -54.14 -28.71 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 124.006 0.922 . . . . 61.31 111.97 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -75.01 -12.69 60.39 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.01 0.433 . . . . 73.42 110.888 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 79.76 25.18 58.83 Favored Glycine 0 N--CA 1.433 -1.554 0 N-CA-C 112.122 -0.391 . . . . 64.31 112.122 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -130.66 149.87 74.79 Favored Pre-proline 0 C--N 1.308 -1.207 0 N-CA-C 107.129 -1.434 . . . . 71.02 107.129 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 487' ' ' PRO . . . . . 0.507 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 12.3 Cg_endo -57.35 130.48 39.46 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.379 2.053 . . . . 73.41 111.576 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 16.3 m -81.35 9.07 7.73 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.299 -0.864 . . . . 74.52 111.033 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 80.6 23.33 60.45 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 109.871 -1.292 . . . . 61.45 109.871 -176.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -142.13 141.25 32.66 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.508 -1.293 . . . . 70.45 107.508 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.51 160.29 28.96 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 122.556 0.342 . . . . 53.51 110.31 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -118.97 144.41 46.5 Favored 'General case' 0 C--N 1.291 -1.974 0 N-CA-C 109.189 -0.671 . . . . 75.22 109.189 175.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.5 131.52 44.24 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 107.577 -1.268 . . . . 72.15 107.577 174.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 494' ' ' GLN . . . . . 0.597 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 33.6 tt0 -104.98 131.94 51.87 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 108.165 -1.05 . . . . 70.51 108.165 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.64 ' SD ' HD11 ' A' ' 447' ' ' ILE . 67.9 mtp -104.43 178.07 4.67 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 123.008 0.523 . . . . 73.34 110.241 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -74.3 -36.05 63.72 Favored 'General case' 0 N--CA 1.407 -2.592 0 C-N-CA 123.329 0.652 . . . . 74.35 111.841 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 69.3 m -144.64 153.66 41.99 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 113.085 0.772 . . . . 63.11 113.085 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.05 68.77 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.523 1.129 . . . . 55.01 111.98 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.56 -49.3 77.93 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 115.783 -0.644 . . . . 72.21 111.62 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.85 -28.7 55.58 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.298 -0.561 . . . . 65.34 111.552 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.67 -43.57 96.31 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.512 0.507 . . . . 73.1 109.858 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -69.3 -38.86 78.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.314 0.578 . . . . 75.03 109.457 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.92 -44.01 97.78 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.285 -0.87 . . . . 42.43 109.622 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.8 97.97 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.877 -0.601 . . . . 35.0 110.6 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -71.58 -22.94 61.66 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 112.079 0.4 . . . . 64.21 112.079 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -85.72 -42.17 14.48 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.602 -0.518 . . . . 64.33 109.602 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -70.48 -38.47 74.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.84 -0.618 . . . . 70.04 109.997 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 56.6 m -107.84 23.8 13.91 Favored 'General case' 0 N--CA 1.421 -1.885 0 CA-C-N 115.831 -0.622 . . . . 62.42 110.92 -177.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 509' ' ' HIS . . . . . 0.449 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 29.3 t-80 -64.93 97.25 0.22 Allowed 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.606 -0.887 . . . . 71.21 108.606 172.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 97.9 mttt 59.32 62.55 1.77 Allowed 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.362 1.065 . . . . 71.32 110.341 -179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -103.71 134.04 47.69 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 114.919 -1.037 . . . . 71.43 109.049 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -73.32 133.33 43.83 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 116.013 -0.54 . . . . 61.11 110.919 -176.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.8 ttt -126.37 104.31 8.11 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 107.95 -1.13 . . . . 70.01 107.95 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.29 -72.66 0.1 Allowed 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 124.825 1.25 . . . . 75.45 110.782 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -141.16 -13.12 0.92 Allowed 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 112.754 0.65 . . . . 54.02 112.754 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 516' ' ' ARG . . . . . 0.409 ' HD3' ' N ' ' A' ' 517' ' ' TYR . 0.0 OUTLIER -124.92 149.72 47.3 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 108.246 -1.02 . . . . 73.11 108.246 -174.388 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 517' ' ' TYR . . . . . 0.409 ' N ' ' HD3' ' A' ' 516' ' ' ARG . 55.7 m-85 -88.25 128.56 35.47 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 112.714 0.635 . . . . 72.41 112.714 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 91.2 t -96.2 112.39 28.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.128 -1.396 . . . . 72.23 107.343 176.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -97.59 114.78 26.77 Favored 'General case' 0 C--N 1.269 -2.892 0 N-CA-C 106.973 -1.492 . . . . 74.51 106.973 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 78.4 t -104.08 123.71 58.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.883 -0.599 . . . . 73.31 109.884 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -121.63 147.92 45.23 Favored 'General case' 0 C--O 1.208 -1.116 0 C-N-CA 124.003 0.921 . . . . 73.34 108.842 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -95.66 152.43 18.46 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.226 0.466 . . . . 73.02 110.939 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.4 m -152.15 170.71 19.31 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 123.128 0.571 . . . . 73.51 110.592 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 35.1 t -105.38 156.78 17.85 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 116.212 -0.449 . . . . 63.14 109.976 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 525' ' ' ALA . . . . . 0.473 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -57.73 -42.89 84.77 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.217 0.451 . . . . 72.13 112.217 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.09 -31.49 70.26 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.68 0.753 . . . . 72.44 109.46 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -72.61 -37.26 68.15 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.999 -1.0 . . . . 51.42 110.678 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 42.8 ttm -61.44 -44.88 96.33 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.655 -0.868 . . . . 62.4 108.655 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -62.41 -38.08 88.29 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.797 -1.092 . . . . 72.42 110.21 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -58.3 -47.89 82.24 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.691 0.796 . . . . 54.42 109.925 177.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.79 -34.42 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.174 0.511 . . . . 54.43 110.302 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 85.0 mt . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 116.355 -0.384 . . . . 64.35 111.722 179.089 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 39.0 t . . . . . 0 C--O 1.252 1.211 0 CA-C-O 121.985 0.898 . . . . 71.42 111.927 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.567 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 98.6 mtt180 -89.5 70.26 7.96 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.099 -0.955 . . . . 74.03 109.991 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -123.22 18.7 9.9 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.256 -1.338 . . . . 72.14 110.497 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 63.6 m -113.43 156.82 22.81 Favored 'General case' 0 N--CA 1.417 -2.116 0 C-N-CA 119.682 -0.807 . . . . 75.5 109.424 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -129.18 139.11 52.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 N-CA-C 108.508 -0.923 . . . . 75.31 108.508 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 -108.2 120.93 43.77 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 107.045 -1.465 . . . . 73.11 107.045 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.486 HD22 HG22 ' A' ' 520' ' ' VAL . 12.3 mt -100.11 145.54 27.85 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.848 -1.538 . . . . 70.24 106.848 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -141.15 137.06 32.45 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 109.998 -0.371 . . . . 73.43 109.998 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 94.41 34.45 6.36 Favored Glycine 0 C--N 1.298 -1.548 0 CA-C-N 115.964 -0.562 . . . . 75.12 113.047 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 88.1 mt -75.3 150.31 85.03 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 116.881 0.341 . . . . 43.55 111.159 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.7 156.24 58.61 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 C-N-CA 122.868 2.379 . . . . 61.41 112.207 176.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -75.31 93.63 2.91 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.029 -1.442 . . . . 75.14 109.731 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 85.07 38.71 0.02 OUTLIER 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 111.841 -2.436 . . . . 75.14 111.388 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.24 137.49 57.04 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.205 -1.035 . . . . 74.2 108.205 169.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 15.4 p -81.5 156.93 25.03 Favored 'General case' 0 N--CA 1.416 -2.156 0 CA-C-N 116.66 -0.246 . . . . 65.21 110.535 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.464 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 63.3 mt -63.17 -32.52 56.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.746 0.784 . . . . 71.41 109.202 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -67.27 -36.14 80.97 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.486 -0.779 . . . . 71.21 110.216 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.08 -35.83 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.185 -0.462 . . . . 63.24 110.372 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.456 HG22 ' HA ' ' A' ' 458' ' ' ILE . 12.5 tt -73.35 -33.47 40.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 120.443 -0.503 . . . . 71.22 110.286 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.3 mt -67.71 -35.46 78.83 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.409 0.623 . . . . 72.32 109.526 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.28 -49.85 74.03 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-N 115.213 -0.903 . . . . 72.3 109.45 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -51.88 -44.97 63.95 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.025 -1.443 . . . . 74.2 111.002 177.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.9 -36.56 83.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.388 -0.823 . . . . 73.23 111.648 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 72.87 -132.17 16.9 Favored Glycine 0 CA--C 1.476 -2.367 0 C-N-CA 120.396 -0.907 . . . . 74.43 111.246 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -52.32 -36.37 53.11 Favored 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 124.973 1.309 . . . . 72.44 109.795 176.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -70.33 -5.8 30.57 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.101 -0.954 . . . . 73.22 112.756 -176.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -72.85 -15.51 61.61 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.421 0.629 . . . . 74.42 109.769 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 28.5 m -91.06 -16.91 27.1 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 121.748 0.785 . . . . 55.31 109.263 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 471' ' ' ASP . . . . . 0.475 ' O ' ' HG3' ' A' ' 495' ' ' MET . 69.2 m-20 -98.26 0.15 45.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.84 -0.618 . . . . 73.25 112.549 -174.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 472' ' ' ILE . . . . . 0.411 ' HA ' ' HA ' ' A' ' 495' ' ' MET . 14.2 tt -79.06 158.39 4.7 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 N-CA-C 108.378 -0.971 . . . . 74.24 108.378 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -87.93 157.57 18.91 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.785 -1.191 . . . . 73.33 107.785 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.2 m -52.19 107.13 0.18 Allowed 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 124.028 0.931 . . . . 74.13 112.298 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 49.3 m80 61.94 29.08 17.7 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.298 1.039 . . . . 70.44 111.408 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -78.06 -3.11 84.41 Favored Glycine 0 N--CA 1.439 -1.159 0 CA-C-N 115.63 -0.714 . . . . 73.03 112.774 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.449 ' HA ' HG13 ' A' ' 493' ' ' ILE . 5.0 p -83.07 103.24 10.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.17 0 CA-C-O 121.507 0.67 . . . . 74.31 110.686 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -114.99 91.75 3.72 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 116.246 -0.434 . . . . 72.24 110.116 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 479' ' ' MET . . . . . 0.437 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 69.8 mtm -77.54 129.07 35.19 Favored 'General case' 0 CA--C 1.489 -1.392 0 N-CA-C 106.23 -1.767 . . . . 62.44 106.23 173.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.0 t -81.13 118.39 28.82 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-O 121.47 0.653 . . . . 72.0 110.523 -173.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 69.8 mt -96.59 152.84 18.25 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.451 -1.314 . . . . 72.04 107.451 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -92.59 -170.44 2.47 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 107.883 -1.154 . . . . 71.14 107.883 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -72.15 -5.2 33.84 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 124.022 0.929 . . . . 65.1 113.275 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -109.87 12.07 24.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-O 121.505 0.669 . . . . 53.44 109.525 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 68.05 31.78 75.69 Favored Glycine 0 CA--C 1.505 -0.558 0 CA-C-N 115.604 -0.725 . . . . 72.11 112.88 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -121.45 142.21 35.02 Favored Pre-proline 0 C--N 1.305 -1.342 0 N-CA-C 107.0 -1.482 . . . . 74.12 107.0 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -52.42 129.86 33.63 Favored 'Trans proline' 0 N--CA 1.477 0.53 0 C-N-CA 123.161 2.574 . . . . 72.42 113.373 -177.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.7 m -77.39 -20.76 54.2 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.859 -0.609 . . . . 53.54 110.118 178.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 114.58 -18.6 17.32 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.66 -0.7 . . . . 75.5 111.699 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -112.78 164.45 13.37 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 120.929 0.395 . . . . 52.15 110.244 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.437 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -155.17 160.28 40.78 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.628 -0.714 . . . . 53.54 109.083 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.52 120.27 25.09 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.518 -1.289 . . . . 74.33 107.518 174.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' ILE . . . . . 0.449 HG13 ' HA ' ' A' ' 477' ' ' VAL . 1.7 mp -111.9 132.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.256 0 N-CA-C 108.393 -0.966 . . . . 70.02 108.393 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -103.45 121.98 43.94 Favored 'General case' 0 C--N 1.258 -3.392 0 N-CA-C 108.022 -1.103 . . . . 71.33 108.022 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 471' ' ' ASP . 2.0 tpt -92.9 171.45 8.96 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.533 -0.758 . . . . 50.33 109.987 -173.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -74.57 -36.59 63.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.007 0.923 . . . . 75.2 109.941 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.2 m -146.51 152.11 38.46 Favored 'General case' 0 N--CA 1.423 -1.819 0 CA-C-N 115.799 -0.637 . . . . 34.41 109.797 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.62 -36.49 78.73 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.108 0.88 . . . . 72.2 111.765 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -61.08 -48.82 79.95 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 115.504 -0.771 . . . . 75.43 110.388 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -68.87 -31.08 69.77 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.556 -1.202 . . . . 74.0 112.294 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.27 -48.29 70.9 Favored 'General case' 0 C--N 1.309 -1.175 0 O-C-N 123.392 0.433 . . . . 73.15 110.041 175.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -66.88 -38.98 87.32 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 116.053 -0.522 . . . . 74.24 110.312 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 47.5 tpp -65.81 -41.28 92.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.99 -0.55 . . . . 65.35 110.532 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.08 77.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 120.902 0.382 . . . . 71.42 110.401 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.466 ' HA ' HG12 ' A' ' 520' ' ' VAL . . . -71.36 -36.98 71.66 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.864 -0.607 . . . . 73.41 111.799 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -46.29 68.1 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 107.588 -1.264 . . . . 73.3 107.588 177.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -62.86 -33.5 75.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.894 -1.048 . . . . 63.44 110.53 -177.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 61.9 m -116.05 19.66 14.86 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 114.83 1.419 . . . . 65.33 114.83 -176.021 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 509' ' ' HIS . . . . . 0.453 ' CD2' ' HD3' ' A' ' 510' ' ' LYS . 12.8 t60 -68.18 108.77 3.27 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 107.809 -1.182 . . . . 73.43 107.809 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.453 ' HD3' ' CD2' ' A' ' 509' ' ' HIS . 14.1 mptt 63.73 52.7 2.14 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 122.173 0.987 . . . . 53.21 110.45 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 511' ' ' LYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 21.9 tptm -89.11 139.63 30.27 Favored 'General case' 0 N--CA 1.412 -2.344 0 CA-C-N 114.539 -1.21 . . . . 74.25 109.194 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -76.9 121.93 24.12 Favored 'General case' 0 C--N 1.284 -2.248 0 N-CA-C 108.188 -1.042 . . . . 72.32 108.188 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -105.84 77.31 1.24 Allowed 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.428 -2.064 . . . . 63.54 105.428 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? 69.75 -81.94 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.812 -1.54 . . . . 65.51 110.022 -172.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -125.67 -4.88 7.05 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-O 122.135 0.969 . . . . 61.14 110.872 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -94.22 160.12 14.83 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.016 -1.476 . . . . 71.23 107.016 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -120.35 118.27 29.94 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.722 -1.584 . . . . 70.23 106.722 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 96.0 t -112.79 134.6 54.88 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.996 0 CA-C-O 121.539 0.685 . . . . 72.13 111.458 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 519' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' A' ' 449' ' ' LEU . 32.0 tt0 -95.5 114.31 26.06 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.399 -0.963 . . . . 74.12 108.399 176.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 520' ' ' VAL . . . . . 0.486 HG22 HD22 ' A' ' 449' ' ' LEU . 57.3 t -109.39 112.84 42.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 N-CA-C 107.729 -1.211 . . . . 60.32 107.729 176.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -128.31 123.39 33.9 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.218 -0.301 . . . . 64.02 111.751 -174.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' GLN . . . . . 0.41 ' OE1' ' HB3' ' A' ' 444' ' ' ARG . 0.6 OUTLIER -70.99 136.0 48.16 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.883 0.373 . . . . 72.2 110.928 -178.784 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 61.4 m -145.01 170.37 16.29 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 124.39 1.076 . . . . 75.24 109.307 -177.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.567 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 40.4 t -82.88 154.15 24.76 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.32 -0.622 . . . . 74.3 109.32 175.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -65.24 -23.57 67.1 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.433 -0.803 . . . . 63.11 109.489 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.98 -45.3 93.08 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.226 -0.657 . . . . 72.03 109.226 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -64.32 -40.63 96.29 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.075 0.464 . . . . 71.34 109.874 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 528' ' ' MET . . . . . 0.483 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.9 ttt -60.07 -47.64 85.05 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.361 -0.836 . . . . 63.42 110.382 178.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.15 -37.92 84.61 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 115.322 -0.854 . . . . 60.51 110.072 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -63.02 -43.0 99.93 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.255 -0.884 . . . . 75.44 110.01 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.83 -37.15 72.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 120.776 -0.369 . . . . 71.55 110.442 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.1 mt . . . . . 0 N--CA 1.467 0.42 0 CA-C-O 120.913 0.387 . . . . 63.24 111.804 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.424 -1.754 0 N-CA-C 107.199 -1.408 . . . . 63.24 107.199 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.599 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 95.5 mtt180 -94.01 75.42 4.13 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 122.313 1.054 . . . . 73.33 108.32 174.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.1 p30 -122.3 10.62 9.95 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 113.39 -1.732 . . . . 74.12 111.456 -172.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 446' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 29.3 m -104.61 141.36 36.57 Favored 'General case' 0 N--CA 1.4 -2.947 0 N-CA-C 108.417 -0.957 . . . . 62.43 108.417 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -123.73 139.11 51.24 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.415 0 N-CA-C 107.766 -1.198 . . . . 60.15 107.766 -177.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 448' ' ' ARG . . . . . 0.467 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.4 ttp180 -114.38 123.95 50.74 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 108.948 -0.76 . . . . 71.44 108.948 175.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.441 ' CD1' HD11 ' A' ' 461' ' ' ILE . 5.6 mt -102.11 138.1 39.5 Favored 'General case' 0 C--N 1.285 -2.235 0 N-CA-C 106.387 -1.709 . . . . 73.22 106.387 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 63.0 ttp180 -132.38 125.06 29.94 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-O 121.168 0.508 . . . . 62.21 110.15 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.42 45.69 1.41 Allowed Glycine 0 C--N 1.272 -2.985 0 CA-C-N 115.1 -0.954 . . . . 75.25 111.111 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 92.9 mt -84.19 140.26 39.49 Favored Pre-proline 0 N--CA 1.433 -1.309 0 O-C-N 122.86 -0.2 . . . . 74.04 110.547 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.55 150.75 33.71 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 123.208 2.606 . . . . 73.35 112.713 176.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -72.97 103.4 3.75 Favored 'General case' 0 N--CA 1.396 -3.169 0 N-CA-C 107.304 -1.369 . . . . 72.2 107.304 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 91.94 33.37 0.01 OUTLIER 'General case' 0 C--N 1.279 -2.469 0 CA-C-N 111.254 -2.703 . . . . 65.45 112.446 175.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -71.44 109.17 5.25 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 107.17 -1.419 . . . . 73.2 107.17 168.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.7 p -75.23 167.79 21.24 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.71 0.291 . . . . 72.33 110.791 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 59.7 mt -63.85 -32.49 57.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.983 0.421 . . . . 74.44 110.392 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.84 -49.75 69.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.306 0.574 . . . . 73.22 109.563 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 34.1 t70 -67.32 -32.14 72.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.277 -0.874 . . . . 75.32 111.324 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.517 HG22 ' HA ' ' A' ' 458' ' ' ILE . 11.2 tt -75.94 -30.37 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 109.959 -0.385 . . . . 75.21 109.959 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.6 mt -68.53 -35.03 76.9 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.25 -0.648 . . . . 73.44 109.25 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 463' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 24.0 t70 -60.04 -51.68 68.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.21 -0.905 . . . . 72.22 109.242 173.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -55.16 -40.21 70.39 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.204 -1.362 . . . . 64.21 111.912 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.54 -31.96 73.3 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.982 -0.554 . . . . 75.32 111.911 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.83 -128.94 15.36 Favored Glycine 0 CA--C 1.474 -2.491 0 C-N-CA 120.447 -0.882 . . . . 54.54 111.922 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -58.93 -28.37 66.18 Favored 'General case' 0 C--N 1.273 -2.735 0 CA-C-N 113.802 -1.199 . . . . 72.12 111.698 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -75.74 -5.88 47.88 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 112.454 0.539 . . . . 65.44 112.454 -178.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.54 63.56 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.309 0.576 . . . . 53.33 111.422 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 16.4 m -97.85 -6.32 32.77 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 121.371 0.605 . . . . 64.12 109.971 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' ASP . . . . . 0.457 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 70.6 m-20 -99.22 -5.73 29.4 Favored 'General case' 0 C--O 1.242 0.69 0 O-C-N 121.94 -0.475 . . . . 44.43 112.2 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' ILE . . . . . 0.462 ' HA ' ' SD ' ' A' ' 495' ' ' MET . 13.0 tt -69.02 148.48 11.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 CA-C-N 115.273 -0.876 . . . . 71.53 109.897 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -72.28 173.39 8.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.132 -0.627 . . . . 62.11 110.499 176.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.9 m -62.05 102.83 0.31 Allowed 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.302 -0.863 . . . . 73.32 108.973 176.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 58.05 52.8 7.31 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.939 1.295 . . . . 74.0 108.281 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -73.72 -16.42 79.2 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.904 -1.044 . . . . 74.44 113.439 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.51 121.39 36.66 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-O 121.701 0.762 . . . . 74.32 111.45 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -132.95 106.84 7.92 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 107.515 -1.291 . . . . 73.35 107.515 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.9 mtt -88.12 139.57 30.37 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 120.214 -0.595 . . . . 74.43 110.306 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 61.8 t -83.54 107.19 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.481 -0.933 . . . . 62.41 108.481 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.7 mt -88.65 154.67 20.12 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 114.436 -1.256 . . . . 75.43 109.748 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -92.81 160.84 14.76 Favored 'General case' 0 C--N 1.284 -2.261 0 N-CA-C 104.72 -2.326 . . . . 73.42 104.72 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -64.51 -14.17 56.02 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 119.2 0.909 . . . . 75.54 112.031 -178.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' GLN . . . . . 0.404 ' OE1' ' HG3' ' A' ' 486' ' ' ARG . 34.9 tt0 -71.31 -16.72 62.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.414 0.685 . . . . 73.41 109.99 173.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.52 33.44 22.3 Favored Glycine 0 N--CA 1.435 -1.397 0 CA-C-O 121.941 0.745 . . . . 61.22 111.285 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.404 ' HG3' ' OE1' ' A' ' 484' ' ' GLN . 4.9 mmp_? -128.61 150.83 75.77 Favored Pre-proline 0 C--N 1.29 -1.98 0 N-CA-C 106.127 -1.805 . . . . 63.53 106.127 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.39 126.58 18.78 Favored 'Trans proline' 0 C--O 1.247 0.968 0 C-N-CA 121.587 1.524 . . . . 71.14 111.39 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 20.0 m -67.92 -24.86 65.24 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.605 0.716 . . . . 63.13 110.198 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 125.86 -20.15 6.44 Favored Glycine 0 N--CA 1.429 -1.784 0 N-CA-C 110.91 -0.876 . . . . 52.42 110.91 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -111.14 154.44 24.32 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.881 0.372 . . . . 61.11 110.752 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.59 40.81 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.286 -0.635 . . . . 63.35 109.286 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' PHE . . . . . 0.467 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 85.4 m-85 -118.36 137.48 53.08 Favored 'General case' 0 C--N 1.293 -1.871 0 N-CA-C 109.315 -0.624 . . . . 74.21 109.315 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 52.5 mt -125.3 124.95 68.27 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.202 0 N-CA-C 107.22 -1.4 . . . . 64.31 107.22 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -102.86 122.93 45.53 Favored 'General case' 0 C--N 1.27 -2.885 0 CA-C-N 115.683 -0.69 . . . . 71.14 110.247 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 472' ' ' ILE . 26.2 mmt -96.45 169.29 10.01 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 123.691 0.796 . . . . 75.42 111.608 -176.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -65.32 -32.47 74.14 Favored 'General case' 0 N--CA 1.421 -1.919 0 CA-C-N 115.492 -0.777 . . . . 64.32 112.737 178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 38.8 p -152.5 163.94 38.57 Favored 'General case' 0 C--O 1.25 1.106 0 CA-C-O 120.587 0.232 . . . . 72.15 111.389 -177.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.24 85.14 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 123.723 0.809 . . . . 63.41 111.443 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -54.45 -50.57 67.37 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.406 -0.816 . . . . 73.11 111.832 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' ARG . . . . . 0.457 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 2.4 mmp_? -64.53 -42.2 95.91 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 113.846 -1.524 . . . . 75.14 109.77 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.04 91.17 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.038 -0.983 . . . . 70.04 110.683 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -64.57 -41.62 96.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.816 -0.629 . . . . 54.32 110.893 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.0 mtp -74.09 -34.61 64.03 Favored 'General case' 0 CA--C 1.508 -0.64 0 C-N-CA 119.625 -0.83 . . . . 63.43 110.85 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.87 -40.4 79.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 116.25 -0.432 . . . . 71.33 110.09 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.7 -38.72 84.04 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 116.112 -0.494 . . . . 73.55 111.195 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -67.8 -42.38 81.66 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.497 -0.32 . . . . 74.11 110.927 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.4 -41.8 75.96 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 120.595 -0.442 . . . . 75.33 110.819 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 47.9 m -95.93 11.39 34.05 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 113.241 0.83 . . . . 65.31 113.241 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -66.17 97.6 0.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 O-C-N 121.324 -0.86 . . . . 74.42 110.861 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.496 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 21.6 ttmm 75.22 33.12 0.72 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.301 1.44 . . . . 71.22 109.484 175.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -80.59 150.4 29.53 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.462 -1.245 . . . . 73.14 109.817 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -80.15 143.56 33.77 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 120.69 0.281 . . . . 75.35 110.528 177.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.4 ttt -140.37 103.67 4.62 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.927 -1.138 . . . . 74.41 107.927 175.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp 66.81 -84.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 125.008 1.323 . . . . 63.42 111.013 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.31 -0.52 2.98 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.919 -0.771 . . . . 65.05 108.919 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -113.7 160.48 18.59 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.127 -1.064 . . . . 74.12 108.127 -172.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -113.45 118.85 35.65 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.659 -0.867 . . . . 70.12 108.659 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.85 112.66 35.73 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 CA-C-O 121.537 0.684 . . . . 64.12 109.558 -176.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 519' ' ' GLU . . . . . 0.496 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 42.0 mt-10 -94.49 112.32 24.09 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 107.724 -1.213 . . . . 74.12 107.724 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.7 t -104.53 127.91 58.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 CA-C-O 121.111 0.481 . . . . 71.41 111.938 -176.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.78 148.36 48.18 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.502 -0.772 . . . . 72.21 109.365 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -100.55 142.06 32.54 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 122.41 0.284 . . . . 65.22 110.453 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.7 p -147.61 173.68 12.48 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.456 0.646 . . . . 74.25 111.839 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 80.3 p -85.02 158.99 20.31 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.217 -0.901 . . . . 74.4 110.584 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 525' ' ' ALA . . . . . 0.552 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -64.67 -29.04 70.04 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.968 -0.56 . . . . 65.32 110.038 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -73.93 -35.77 64.62 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 116.047 -0.524 . . . . 74.42 110.313 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -64.42 -47.14 80.27 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.379 -0.971 . . . . 73.12 108.379 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 23.5 ttt -60.45 -42.98 97.27 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.511 -1.222 . . . . 62.13 109.969 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -60.72 -45.51 93.99 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.017 -0.992 . . . . 74.43 109.63 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.59 -40.86 98.03 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.865 0.364 . . . . 74.1 111.076 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.25 -39.8 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.339 0.59 . . . . 71.04 110.751 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.317 -0.827 0 N-CA-C 112.649 0.611 . . . . 72.45 112.649 -176.76 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 23.3 t . . . . . 0 C--O 1.254 1.318 0 CA-C-O 121.19 0.519 . . . . 73.23 110.584 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.579 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 69.0 ttt180 -83.88 68.23 9.89 Favored 'General case' 0 N--CA 1.41 -2.459 0 N-CA-C 108.806 -0.813 . . . . 74.24 108.806 174.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -119.66 16.38 12.79 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.229 1.012 . . . . 71.11 111.064 -178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 39.4 m -112.25 162.52 15.4 Favored 'General case' 0 N--CA 1.414 -2.257 0 N-CA-C 108.376 -0.972 . . . . 74.31 108.376 -176.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -128.18 138.42 54.73 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 N-CA-C 107.254 -1.387 . . . . 64.51 107.254 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -111.16 120.16 41.37 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 107.291 -1.374 . . . . 73.42 107.291 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.552 HD22 HG22 ' A' ' 520' ' ' VAL . 11.1 mt -97.56 139.16 33.88 Favored 'General case' 0 C--N 1.283 -2.314 0 N-CA-C 106.325 -1.731 . . . . 64.34 106.325 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -138.1 132.32 31.86 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 109.226 -0.657 . . . . 72.23 109.226 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 102.83 38.56 2.91 Favored Glycine 0 C--N 1.289 -2.073 0 N-CA-C 110.441 -1.064 . . . . 64.04 110.441 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.82 138.03 96.34 Favored Pre-proline 0 C--O 1.243 0.75 0 CA-C-N 115.434 -0.383 . . . . 70.21 111.761 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.11 171.93 6.92 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.339 2.693 . . . . 63.23 113.41 176.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -77.65 99.51 5.82 Favored 'General case' 0 N--CA 1.394 -3.25 0 CA-C-N 113.44 -1.709 . . . . 74.01 108.959 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 79.57 33.42 0.21 Allowed 'General case' 0 C--N 1.272 -2.778 0 CA-C-N 112.157 -2.292 . . . . 74.31 112.005 170.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.38 113.31 2.85 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.149 -1.056 . . . . 65.3 108.149 171.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.6 p -80.12 170.09 16.92 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 116.361 -0.381 . . . . 74.24 111.336 -175.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.5 pt -61.43 -34.45 61.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 N-CA-C 112.225 0.454 . . . . 73.1 112.225 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.12 -33.77 63.69 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 119.625 -0.83 . . . . 73.13 110.66 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.27 -37.71 74.94 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.038 0.447 . . . . 53.52 110.511 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.472 HG22 ' HA ' ' A' ' 458' ' ' ILE . 14.0 tt -70.65 -37.57 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 116.251 -0.431 . . . . 65.33 110.22 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 94.5 mt -67.62 -35.24 78.56 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.151 0.5 . . . . 74.1 110.121 177.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -62.95 -47.79 81.68 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.716 -0.675 . . . . 74.32 109.25 177.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -56.67 -42.87 79.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.562 -1.199 . . . . 71.42 110.938 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.77 -29.26 70.49 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.71 -0.677 . . . . 73.14 111.415 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.65 -121.13 21.41 Favored Glycine 0 CA--C 1.475 -2.468 0 CA-C-O 122.044 0.802 . . . . 63.43 113.088 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -51.75 -41.07 61.31 Favored 'General case' 0 C--N 1.266 -3.058 0 CA-C-N 112.675 -1.762 . . . . 61.42 111.405 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -82.36 1.87 35.09 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.608 -0.723 . . . . 64.52 112.52 -172.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -75.54 -15.67 60.35 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-O 121.078 0.466 . . . . 74.25 111.215 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 22.8 m -92.04 -14.47 29.29 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.342 0.592 . . . . 73.21 110.327 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' ASP . . . . . 0.455 ' CB ' ' HG2' ' A' ' 500' ' ' ARG . 2.9 m-20 -100.27 3.21 43.35 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 116.102 -0.499 . . . . 73.34 112.295 -176.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 472' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.6 tt -73.31 148.79 8.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 N-CA-C 108.26 -1.015 . . . . 63.33 108.26 176.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 473' ' ' ARG . . . . . 0.409 ' O ' HG12 ' A' ' 472' ' ' ILE . 71.8 mtp180 -79.21 156.99 27.92 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.95 -1.13 . . . . 71.3 107.95 174.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 2.0 p -61.15 110.82 1.49 Allowed 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 112.487 0.551 . . . . 71.33 112.487 -178.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 63.21 35.26 12.78 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.664 1.186 . . . . 61.43 108.899 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.85 -10.52 83.62 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 114.854 -1.066 . . . . 71.3 111.202 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.2 p -81.21 105.07 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-O 122.162 0.982 . . . . 55.3 110.654 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -113.11 98.85 7.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.05 -0.977 . . . . 74.21 109.809 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 67.8 mtm -82.15 130.99 35.23 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.995 -1.113 . . . . 55.22 107.995 177.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 480' ' ' VAL . . . . . 0.518 ' O ' ' HA ' ' A' ' 487' ' ' PRO . 52.3 t -82.98 122.14 36.99 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 107.378 -1.342 . . . . 64.22 107.378 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.9 mt -99.99 154.9 18.02 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.226 0.536 . . . . 54.03 110.948 -175.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -102.72 175.66 5.42 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 105.417 -2.068 . . . . 64.25 105.417 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -60.0 -24.91 64.84 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.389 0.541 . . . . 72.35 110.713 -178.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' GLN . . . . . 0.48 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 8.6 tt0 -68.29 -17.24 64.23 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 123.684 0.794 . . . . 73.31 111.095 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.24 28.9 35.18 Favored Glycine 0 N--CA 1.441 -1.002 0 CA-C-N 116.151 -0.477 . . . . 65.03 112.168 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.48 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 96.3 mtt180 -131.98 153.63 81.44 Favored Pre-proline 0 C--N 1.302 -1.474 0 N-CA-C 107.734 -1.21 . . . . 73.24 107.734 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 487' ' ' PRO . . . . . 0.518 ' HA ' ' O ' ' A' ' 480' ' ' VAL . 11.5 Cg_endo -56.32 133.25 56.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.514 2.143 . . . . 64.42 111.509 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 22.5 m -64.87 -12.57 50.21 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 123.751 0.82 . . . . 73.42 111.334 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 123.73 -12.72 8.24 Favored Glycine 0 CA--C 1.48 -2.108 0 N-CA-C 110.685 -0.966 . . . . 71.23 110.685 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' ASP . . . . . 0.412 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.6 p-10 -124.74 156.21 38.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-O 121.104 0.478 . . . . 72.24 110.601 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.5 150.79 29.97 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.195 -0.911 . . . . 70.11 108.751 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -112.04 127.87 56.02 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 108.906 -0.776 . . . . 75.14 108.906 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.54 128.75 73.8 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 107.921 -1.14 . . . . 73.41 107.921 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -104.29 124.36 49.03 Favored 'General case' 0 C--N 1.276 -2.589 0 CA-C-N 115.99 -0.55 . . . . 74.32 110.834 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -93.88 170.65 9.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.495 -0.775 . . . . 74.01 111.171 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -69.48 -28.54 66.16 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.87 -1.059 . . . . 73.02 110.097 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.5 m -154.42 151.16 28.66 Favored 'General case' 0 C--O 1.253 1.261 0 N-CA-C 109.332 -0.618 . . . . 74.31 109.332 -175.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.42 -25.71 68.1 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.119 0.968 . . . . 65.5 112.847 -177.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 499' ' ' ASP . . . . . 0.432 ' HB2' ' HD2' ' A' ' 500' ' ' ARG . 3.3 m-20 -54.69 -51.65 64.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.811 0.815 . . . . 74.53 110.083 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 500' ' ' ARG . . . . . 0.455 ' HG2' ' CB ' ' A' ' 471' ' ' ASP . 10.1 mpt_? -65.88 -38.0 87.64 Favored 'General case' 0 CA--C 1.496 -1.127 0 CA-C-N 114.426 -1.261 . . . . 74.23 110.381 -176.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.44 88.91 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.45 -0.795 . . . . 54.22 110.84 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 502' ' ' PHE . . . . . 0.412 ' HA ' ' HG3' ' A' ' 522' ' ' GLN . 66.2 t80 -68.66 -40.87 80.0 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.23 0.538 . . . . 61.42 110.177 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 66.6 mtt -70.31 -38.08 74.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.78 -0.646 . . . . 74.03 110.79 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.47 -41.98 83.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.305 -0.407 . . . . 64.21 110.37 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.46 ' HA ' HG12 ' A' ' 520' ' ' VAL . . . -67.41 -38.15 84.17 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 116.365 -0.38 . . . . 71.14 110.827 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -70.39 -39.51 74.47 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.747 -0.381 . . . . 73.21 111.1 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.57 -28.49 56.26 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.014 0.435 . . . . 74.42 111.128 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 39.7 m -114.99 18.56 16.31 Favored 'General case' 0 C--O 1.254 1.294 0 N-CA-C 113.13 0.789 . . . . 73.05 113.13 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -68.51 106.6 2.61 Favored 'General case' 0 C--O 1.243 0.715 0 O-C-N 121.052 -1.03 . . . . 73.22 109.868 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 81.3 tttt 72.53 29.8 2.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.833 1.253 . . . . 61.23 109.831 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.08 146.81 35.01 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.725 -1.125 . . . . 72.12 109.123 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 517' ' ' TYR . 9.0 p30 -87.28 137.28 32.47 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 120.525 -0.47 . . . . 43.5 111.171 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.5 ttt -125.42 91.65 3.46 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.511 -1.292 . . . . 74.04 107.511 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.6 -86.75 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.764 -1.107 . . . . 74.21 112.505 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.37 -27.16 13.61 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 113.424 0.898 . . . . 63.53 113.424 -172.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -130.6 157.84 41.63 Favored 'General case' 0 C--N 1.274 -2.69 0 CA-C-N 115.854 -0.612 . . . . 72.24 110.836 -167.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 517' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 512' ' ' ASN . 97.6 m-85 -95.56 125.85 40.44 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.152 -0.684 . . . . 75.51 109.152 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 66.7 t -106.92 117.24 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.543 0 CA-C-N 114.994 -1.003 . . . . 74.33 109.764 -175.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -81.7 110.6 17.19 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 107.125 -1.435 . . . . 52.14 107.125 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 520' ' ' VAL . . . . . 0.552 HG22 HD22 ' A' ' 449' ' ' LEU . 75.4 t -103.57 107.65 22.7 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 107.388 -1.338 . . . . 71.24 107.388 177.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -116.43 144.25 44.54 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.965 -0.754 . . . . 63.2 108.965 -175.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 522' ' ' GLN . . . . . 0.412 ' HG3' ' HA ' ' A' ' 502' ' ' PHE . 0.2 OUTLIER -89.04 123.8 33.68 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.769 -1.197 . . . . 55.1 107.769 -175.891 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 88.7 m -132.37 174.07 10.63 Favored 'General case' 0 C--N 1.283 -2.31 0 N-CA-C 113.434 0.902 . . . . 64.22 113.434 -169.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.579 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.0 t -103.6 154.09 19.88 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.096 -0.956 . . . . 72.53 111.779 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -69.49 -17.26 63.59 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.285 -0.871 . . . . 72.41 109.853 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.42 -46.28 33.68 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.875 -0.602 . . . . 72.31 109.725 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 527' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 524' ' ' SER . 13.5 pt-20 -71.57 -28.64 63.98 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.867 -0.79 . . . . 74.43 108.867 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 528' ' ' MET . . . . . 0.578 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.4 ttt -59.27 -51.64 69.07 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.392 -0.822 . . . . 75.24 109.213 174.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.92 -35.92 82.26 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.435 -0.802 . . . . 70.31 110.144 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.98 -47.79 83.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.533 -0.758 . . . . 71.43 110.583 175.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.15 -35.72 72.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.46 -0.336 . . . . 71.41 110.889 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 532' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 528' ' ' MET . 77.4 mt . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 121.165 0.507 . . . . 73.43 110.018 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 C--O 1.248 0.988 0 CA-C-O 121.265 0.555 . . . . 74.41 110.894 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.599 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 8.0 ptp180 -83.89 65.35 8.58 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 122.024 0.916 . . . . 72.31 112.062 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -103.34 6.23 37.77 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.118 -0.946 . . . . 75.14 111.225 -178.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 38.4 m -107.91 155.08 20.69 Favored 'General case' 0 N--CA 1.415 -2.185 0 N-CA-C 108.852 -0.795 . . . . 52.14 108.852 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -132.57 141.18 45.8 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.379 0 N-CA-C 106.99 -1.485 . . . . 73.35 106.99 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 448' ' ' ARG . . . . . 0.467 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.5 ttp180 -116.24 123.61 48.15 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.863 -0.792 . . . . 74.24 108.863 173.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.458 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 1.6 mt -97.5 135.14 39.78 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 105.82 -1.919 . . . . 75.43 105.82 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -136.39 135.0 38.41 Favored 'General case' 0 C--N 1.287 -2.126 0 C-N-CA 119.771 -0.772 . . . . 50.33 110.889 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 107.11 23.97 6.78 Favored Glycine 0 N--CA 1.432 -1.627 0 N-CA-C 110.399 -1.081 . . . . 52.01 110.399 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.72 144.61 97.88 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 112.965 0.728 . . . . 73.03 112.965 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -55.19 149.54 44.25 Favored 'Trans proline' 0 CA--C 1.492 -1.591 0 C-N-CA 123.107 2.538 . . . . 63.01 112.182 175.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -77.34 106.63 9.21 Favored 'General case' 1 N--CA 1.37 -4.465 0 N-CA-C 106.123 -1.806 . . . . 63.24 106.123 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 92.52 31.19 0.01 OUTLIER 'General case' 0 C--N 1.282 -2.343 0 CA-C-N 111.299 -2.682 . . . . 62.43 112.469 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.7 117.32 12.07 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.269 -1.382 . . . . 75.43 107.269 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.0 p -88.25 173.94 8.49 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.063 0.459 . . . . 65.31 111.722 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.505 ' HA ' HG22 ' A' ' 461' ' ' ILE . 2.5 pp -64.02 -18.55 22.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.55 0.69 . . . . 72.11 111.881 175.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -79.85 -40.43 28.45 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 109.221 -0.659 . . . . 72.22 109.221 175.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.3 -43.58 94.28 Favored 'General case' 0 CA--C 1.497 -1.069 0 CA-C-N 115.859 -0.61 . . . . 53.01 110.731 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.505 HG22 ' HA ' ' A' ' 458' ' ' ILE . 15.9 tt -68.93 -32.83 56.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.572 -0.74 . . . . 74.25 111.173 -176.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.448 HD23 ' O ' ' A' ' 458' ' ' ILE . 3.9 mm? -74.54 -36.3 63.14 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.79 0.328 . . . . 64.21 110.679 176.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.13 -47.97 82.19 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 108.789 -0.819 . . . . 74.12 108.789 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -52.56 -42.06 64.11 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 113.461 -1.699 . . . . 73.11 111.37 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 465' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 493' ' ' ILE . 83.0 mt -63.63 -37.17 86.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.924 -0.58 . . . . 60.22 112.391 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.36 -130.33 18.4 Favored Glycine 0 CA--C 1.484 -1.844 0 C-N-CA 119.773 -1.203 . . . . 62.42 111.765 -177.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.92 -26.67 66.12 Favored 'General case' 0 C--N 1.274 -2.689 0 C-N-CA 124.463 1.105 . . . . 74.52 112.093 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -71.38 -11.73 61.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 73.43 111.511 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.36 -15.54 62.87 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.16 -0.473 . . . . 51.01 111.48 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.2 m -78.2 -28.05 47.95 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-O 121.099 0.476 . . . . 74.15 110.253 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -100.46 10.8 40.7 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.623 0.725 . . . . 74.11 111.507 -172.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 13.4 tt -67.94 142.92 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 N-CA-C 109.504 -0.554 . . . . 74.24 109.504 178.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 473' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 495' ' ' MET . 1.6 tpt180 -66.67 155.8 36.98 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.898 -1.149 . . . . 53.33 107.898 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 86.9 m -64.46 106.66 1.18 Allowed 'General case' 0 C--N 1.296 -1.744 0 O-C-N 123.403 0.439 . . . . 74.43 109.995 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 12.2 m170 64.2 27.78 13.96 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.988 0.915 . . . . 74.45 109.859 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.5 -19.32 70.74 Favored Glycine 0 C--N 1.337 0.621 0 CA-C-N 114.955 -1.021 . . . . 60.14 114.055 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.4 p -76.2 118.88 23.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-O 121.455 0.645 . . . . 63.51 110.403 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -134.07 111.49 10.4 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.809 -0.811 . . . . 74.21 108.809 -178.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 76.4 mtp -88.31 139.57 30.35 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.727 -0.789 . . . . 73.23 109.311 179.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.0 t -83.71 100.96 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 108.27 -1.011 . . . . 73.21 108.27 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.45 146.82 23.84 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.69 -1.226 . . . . 75.21 107.69 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -89.17 -172.97 3.86 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 108.304 -0.999 . . . . 64.4 108.304 -176.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -63.61 -26.83 68.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.104 0.478 . . . . 61.53 111.048 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -74.87 -7.21 52.82 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-O 121.482 0.658 . . . . 73.15 110.763 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.0 30.9 62.55 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.793 -0.523 . . . . 71.24 111.793 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -131.06 150.75 77.46 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 106.993 -1.484 . . . . 73.11 106.993 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.42 125.04 17.56 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 122.968 2.445 . . . . 53.45 114.2 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 38.4 m -69.31 -28.62 66.42 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.276 -0.875 . . . . 70.42 110.246 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 133.41 -21.07 4.1 Favored Glycine 0 CA--C 1.493 -1.307 0 CA-C-N 115.59 -0.732 . . . . 52.44 111.526 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 490' ' ' ASP . . . . . 0.458 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 20.3 p-10 -110.72 151.87 27.23 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.336 0.589 . . . . 64.22 111.302 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.77 155.27 36.86 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.662 -0.866 . . . . 64.22 108.662 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 492' ' ' PHE . . . . . 0.467 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 77.6 m-85 -111.48 142.11 44.18 Favored 'General case' 0 C--N 1.284 -2.255 0 CA-C-O 121.063 0.459 . . . . 73.53 110.456 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 493' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 465' ' ' LEU . 67.8 mt -126.8 139.72 51.02 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 105.399 -2.074 . . . . 62.45 105.399 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -121.16 136.16 55.03 Favored 'General case' 0 C--N 1.274 -2.715 0 C-N-CA 119.905 -0.718 . . . . 64.4 109.443 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.402 ' O ' ' HD3' ' A' ' 473' ' ' ARG . 0.2 OUTLIER -103.9 173.7 6.19 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 123.686 0.616 . . . . 72.04 110.242 176.401 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -70.26 -42.08 72.62 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-O 121.197 0.522 . . . . 73.22 110.103 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 497' ' ' SER . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 500' ' ' ARG . 36.6 t -130.38 156.82 44.08 Favored 'General case' 0 N--CA 1.412 -2.331 0 CA-C-N 115.587 -0.733 . . . . 61.15 111.141 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.45 -28.36 66.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.79 -1.095 . . . . 75.42 111.262 -177.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.21 -47.82 84.35 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 116.185 -0.461 . . . . 75.54 111.434 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 500' ' ' ARG . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 497' ' ' SER . 0.5 OUTLIER -74.18 -32.75 63.2 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.031 -0.668 . . . . 74.12 111.076 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.34 96.34 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 123.447 0.467 . . . . 73.54 110.352 177.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -65.65 -42.6 91.24 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.869 -0.605 . . . . 74.31 110.038 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 16.0 tpt -67.91 -37.62 81.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.01 -0.541 . . . . 65.42 110.508 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.62 92.8 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.322 -0.399 . . . . 73.05 109.98 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.84 -38.71 86.93 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-O 120.72 0.295 . . . . 72.2 111.022 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -67.32 -41.38 85.38 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.831 0.348 . . . . 60.25 110.583 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -68.38 -39.59 81.69 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.869 -0.605 . . . . 54.04 110.79 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 508' ' ' CYS . . . . . 0.6 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 49.1 m -99.35 14.22 30.45 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 113.187 0.81 . . . . 71.13 113.187 -175.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -64.83 105.01 0.92 Allowed 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.013 -0.736 . . . . 64.34 109.013 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt 69.9 20.5 6.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.613 1.165 . . . . 61.53 111.648 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 511' ' ' LYS . . . . . 0.6 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 26.5 tptp -70.83 142.17 51.29 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 124.073 0.949 . . . . 71.3 109.076 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -97.97 143.28 28.71 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 119.319 -0.952 . . . . 62.11 110.848 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 44.3 ttm -111.16 114.32 27.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 104.544 -2.391 . . . . 72.13 104.544 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 97.4 mttt 67.16 -85.42 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.344 1.027 . . . . 64.41 109.011 -172.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -137.73 -8.89 1.63 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.466 0.65 . . . . 75.44 111.043 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -92.3 135.17 34.24 Favored 'General case' 0 CA--C 1.485 -1.524 0 N-CA-C 109.0 -0.741 . . . . 74.4 109.0 -175.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -87.01 132.25 33.85 Favored 'General case' 0 C--N 1.259 -3.335 0 CA-C-N 115.586 -0.734 . . . . 74.32 109.678 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 57.6 t -122.43 127.3 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 N-CA-C 108.727 -0.842 . . . . 70.52 108.727 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -93.68 115.6 28.06 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.742 -1.207 . . . . 73.34 107.742 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 520' ' ' VAL . . . . . 0.422 HG22 HD22 ' A' ' 449' ' ' LEU . 94.3 t -104.34 127.06 58.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 CA-C-N 116.392 -0.367 . . . . 62.02 110.93 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -131.53 150.91 51.98 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.008 -0.542 . . . . 75.33 110.766 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -82.7 156.63 23.69 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.168 0.587 . . . . 62.05 110.098 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 66.0 m -157.23 166.56 32.82 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 122.966 0.506 . . . . 74.14 110.163 -176.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 58.5 p -97.06 155.28 16.87 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.916 -0.584 . . . . 65.31 110.32 177.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.45 62.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.127 -0.488 . . . . 53.12 111.688 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.99 -45.91 66.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.575 -0.528 . . . . 74.55 109.575 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.06 -41.7 97.26 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.418 0.628 . . . . 74.13 109.58 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -60.39 -44.41 95.69 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.788 -1.096 . . . . 73.31 110.81 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.13 -40.74 78.09 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.657 -0.498 . . . . 71.0 109.657 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.3 -41.94 97.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.903 -0.59 . . . . 72.12 110.986 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 96.0 t -72.6 -35.85 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 120.71 -0.396 . . . . 74.35 110.766 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 78.6 mt . . . . . 0 C--N 1.323 -0.583 0 CA-C-O 121.302 0.573 . . . . 71.34 111.399 179.547 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 52.5 t . . . . . 0 C--O 1.245 0.858 0 N-CA-C 108.674 -0.862 . . . . 63.34 108.674 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.601 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 32.3 mtp180 -93.67 67.82 3.92 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 119.645 -0.822 . . . . 73.1 109.353 178.224 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -99.2 12.54 35.88 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.589 -0.732 . . . . 73.1 110.966 -175.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 27.8 m -117.03 149.5 40.18 Favored 'General case' 0 N--CA 1.412 -2.325 0 N-CA-C 108.646 -0.872 . . . . 63.31 108.646 -178.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 447' ' ' ILE . . . . . 0.723 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.3 mt -126.96 151.03 33.33 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.76 0 N-CA-C 107.056 -1.461 . . . . 53.02 107.056 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -125.36 124.81 42.35 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.808 -1.182 . . . . 73.11 107.808 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 15.2 mt -100.78 142.66 31.94 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 107.117 -1.438 . . . . 73.14 107.117 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -144.3 126.99 16.14 Favored 'General case' 0 C--N 1.284 -2.263 0 CA-C-O 121.849 0.833 . . . . 74.41 110.669 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 108.63 32.75 3.05 Favored Glycine 0 C--N 1.279 -2.637 0 CA-C-N 114.754 -1.112 . . . . 61.43 110.781 -177.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 95.4 mt -59.98 140.93 90.23 Favored Pre-proline 0 C--O 1.241 0.616 0 N-CA-C 112.07 0.396 . . . . 73.14 112.07 -179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 453' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 452' ' ' LEU . 27.4 Cg_exo -61.08 170.57 4.75 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.104 2.536 . . . . 63.54 113.874 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.95 93.13 4.38 Favored 'General case' 0 N--CA 1.403 -2.785 0 CA-C-N 113.573 -1.649 . . . . 72.33 109.694 178.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 83.06 28.89 0.09 Allowed 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 113.007 -1.906 . . . . 70.03 112.695 171.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -61.4 132.67 54.25 Favored 'General case' 0 C--O 1.246 0.907 0 N-CA-C 108.686 -0.857 . . . . 65.53 108.686 173.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 73.1 p -95.97 176.52 6.08 Favored 'General case' 0 N--CA 1.418 -2.028 0 CA-C-O 121.695 0.759 . . . . 74.41 112.362 -174.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 31.9 pt -65.02 -26.32 39.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.06 0 CA-C-N 115.071 -0.968 . . . . 74.02 111.536 176.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -76.85 -32.29 57.43 Favored 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 119.473 -0.891 . . . . 74.45 110.19 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.84 -42.35 99.71 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.984 -0.553 . . . . 72.12 110.15 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.402 HG22 ' O ' ' A' ' 458' ' ' ILE . 11.8 tt -69.03 -36.03 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 120.606 -0.437 . . . . 71.45 110.666 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 97.6 mt -67.49 -38.99 85.19 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 120.951 0.405 . . . . 73.23 110.246 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -62.51 -51.3 67.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.464 -0.789 . . . . 63.5 109.327 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 94.4 t80 -55.94 -39.4 71.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 113.912 -1.495 . . . . 75.34 111.42 -178.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 71.5 mt -71.31 -32.78 69.02 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.765 -0.652 . . . . 63.21 112.666 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 73.28 -134.06 19.07 Favored Glycine 0 CA--C 1.48 -2.101 0 C-N-CA 119.252 -1.452 . . . . 51.11 111.244 -178.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -64.55 -21.57 66.73 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-N 114.629 -0.785 . . . . 53.15 111.158 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -67.08 -14.18 62.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.277 0.56 . . . . 74.33 110.535 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 469' ' ' ALA . . . . . 0.429 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -71.27 -14.84 62.36 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.025 -0.534 . . . . 63.22 111.151 177.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 27.7 m -84.17 -23.98 30.37 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-O 121.776 0.798 . . . . 72.01 109.028 176.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -90.92 -11.27 39.62 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.44 -0.8 . . . . 72.34 111.999 -175.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 472' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 469' ' ' ALA . 9.5 tt -77.17 132.92 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 N-CA-C 108.868 -0.79 . . . . 52.53 108.868 176.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 -72.71 159.34 33.97 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.942 -0.392 . . . . 71.1 109.942 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 72.1 m -57.18 113.1 1.58 Allowed 'General case' 0 C--O 1.246 0.92 0 CA-C-O 121.286 0.565 . . . . 75.32 111.761 -174.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 62.82 37.35 12.38 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 114.329 -1.305 . . . . 75.12 108.764 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -70.46 -14.29 71.84 Favored Glycine 0 N--CA 1.436 -1.356 0 CA-C-N 115.062 -0.972 . . . . 62.15 111.707 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 492' ' ' PHE . 4.2 p -83.38 101.85 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.87 0 CA-C-O 122.089 0.947 . . . . 74.31 110.588 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -107.78 101.87 11.13 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.45 -0.944 . . . . 75.45 108.45 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 479' ' ' MET . . . . . 0.511 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 46.5 ttm -80.59 137.09 36.35 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 120.908 0.385 . . . . 51.4 110.95 -177.026 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 59.5 t -90.36 111.46 23.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 CA-C-N 115.682 -0.69 . . . . 44.01 110.529 -177.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 2.2 pp -92.91 156.9 16.65 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.289 -0.868 . . . . 51.44 110.415 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -97.21 -169.03 1.79 Allowed 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.891 -1.522 . . . . 63.02 106.891 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -60.02 -30.17 68.99 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 123.342 0.657 . . . . 70.44 111.49 -178.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -73.63 -17.83 61.11 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.039 0.447 . . . . 73.42 110.891 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 89.77 19.41 47.98 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.481 -0.866 . . . . 71.5 111.884 -177.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.456 ' HD3' ' O ' ' A' ' 487' ' ' PRO . 0.1 OUTLIER -118.85 146.7 40.71 Favored Pre-proline 0 N--CA 1.445 -0.676 0 N-CA-C 107.211 -1.403 . . . . 75.51 107.211 179.252 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 487' ' ' PRO . . . . . 0.511 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 10.2 Cg_endo -53.39 133.2 52.15 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 C-N-CA 123.325 2.684 . . . . 75.34 113.265 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 21.1 m -80.02 0.02 33.54 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.674 0.75 . . . . 74.34 109.509 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 94.02 2.07 64.73 Favored Glycine 0 N--CA 1.426 -1.998 0 N-CA-C 110.411 -1.076 . . . . 53.52 110.411 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 490' ' ' ASP . . . . . 0.503 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 18.0 t70 -114.61 146.19 41.11 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.313 -1.366 . . . . 74.04 107.313 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -160.17 162.59 33.92 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 109.619 -0.512 . . . . 64.41 109.619 -177.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 492' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 87.3 m-85 -115.73 145.87 42.4 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 120.646 0.26 . . . . 71.15 110.558 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.1 mt -118.07 134.88 60.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 105.988 -1.856 . . . . 74.44 105.988 172.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -118.72 109.66 16.35 Favored 'General case' 0 C--N 1.27 -2.861 0 N-CA-C 109.414 -0.587 . . . . 73.12 109.414 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.723 ' SD ' HD11 ' A' ' 447' ' ' ILE . 71.8 mtp -104.11 169.15 8.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.957 -0.565 . . . . 74.35 111.043 -175.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.22 -53.13 60.76 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 123.441 0.697 . . . . 74.0 111.775 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -121.2 146.04 47.2 Favored 'General case' 0 N--CA 1.419 -2.009 0 CA-C-N 115.669 -0.696 . . . . 64.34 112.142 -169.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.96 66.57 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-N 114.949 -1.023 . . . . 72.31 109.997 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -68.17 -46.91 69.45 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 122.103 0.954 . . . . 74.42 109.339 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -68.71 -38.78 80.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 114.02 -1.446 . . . . 75.04 109.274 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.14 -38.32 87.85 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.33 -0.85 . . . . 73.13 110.603 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -64.27 -42.54 96.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.585 -0.524 . . . . 73.43 109.585 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.3 mtp -61.88 -43.41 98.91 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.389 -0.369 . . . . 71.44 110.244 178.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.3 96.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.494 -0.775 . . . . 73.01 110.7 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.11 -30.28 67.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.969 0.414 . . . . 43.32 111.382 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -46.56 64.01 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.866 -0.606 . . . . 64.53 110.247 176.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 507' ' ' LYS . . . . . 0.577 ' HE3' ' HA ' ' A' ' 507' ' ' LYS . 1.4 tpmt? -75.7 -31.99 59.92 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.085 0.469 . . . . 73.41 110.582 -175.669 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 44.1 m -96.41 9.14 42.2 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 120.967 0.413 . . . . 65.41 111.918 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -63.47 101.85 0.37 Allowed 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.294 -0.632 . . . . 73.12 109.294 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 54.54 66.52 1.21 Allowed 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.532 1.533 . . . . 71.1 110.138 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -97.11 141.89 29.71 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 113.634 -1.621 . . . . 51.02 109.49 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.424 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 4.2 m-20 -92.72 116.53 29.1 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 108.214 -1.032 . . . . 71.41 108.214 175.115 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.0 ttt -103.6 103.91 13.91 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 107.336 -1.357 . . . . 71.23 107.336 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 89.0 mttt 67.57 -77.91 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.372 1.069 . . . . 75.44 109.791 -175.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -135.4 -12.17 2.11 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 123.444 0.697 . . . . 60.22 110.926 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 516' ' ' ARG . . . . . 0.424 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 28.2 tpt180 -88.83 152.75 21.57 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.035 -0.53 . . . . 72.14 109.723 -172.363 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.82 118.21 36.02 Favored 'General case' 0 C--N 1.291 -1.96 0 N-CA-C 107.356 -1.35 . . . . 72.44 107.356 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 60.0 t -114.5 116.98 54.2 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 109.046 -0.724 . . . . 53.24 109.046 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -95.95 110.87 23.01 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.604 -0.887 . . . . 63.31 108.604 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.51 135.21 44.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-N 115.999 -0.546 . . . . 62.01 111.868 -177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -126.35 162.22 26.02 Favored 'General case' 0 C--O 1.215 -0.728 0 C-N-CA 124.35 1.06 . . . . 72.13 109.19 176.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -100.71 157.61 16.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.815 -0.809 . . . . 73.24 108.815 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -156.68 163.43 39.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-O 121.892 0.853 . . . . 65.22 111.501 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 3.6 m -97.74 158.81 15.3 Favored 'General case' 0 C--N 1.271 -2.839 0 CA-C-N 114.722 -1.126 . . . . 63.51 108.555 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -57.24 -33.88 68.02 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 122.019 0.914 . . . . 72.23 108.869 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.4 -41.34 98.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.375 -1.284 . . . . 64.43 110.29 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 527' ' ' GLU . . . . . 0.434 ' O ' HG23 ' A' ' 531' ' ' VAL . 38.3 mt-10 -69.95 -36.53 75.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.213 -0.448 . . . . 73.45 110.095 178.321 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 46.2 ttm -63.7 -43.7 95.84 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.162 -0.681 . . . . 63.0 109.162 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -61.55 -40.28 94.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.212 -0.904 . . . . 74.14 109.593 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -63.69 -41.3 98.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.994 -0.548 . . . . 63.23 110.643 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 531' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 527' ' ' GLU . 98.9 t -65.35 -31.44 53.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.143 0.497 . . . . 63.22 110.499 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.304 -1.39 0 CA-C-O 121.317 0.579 . . . . 73.44 111.126 175.638 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.434 -1.265 0 N-CA-C 106.377 -1.712 . . . . 71.5 106.377 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.595 ' HA ' ' HA ' ' A' ' 524' ' ' SER 0.258 9.4 ptm85 -92.98 73.95 4.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 114.51 1.3 . . . . 72.23 114.51 -176.265 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.66 9.27 17.8 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.097 -0.956 . . . . 52.45 108.898 177.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 17.2 m -107.53 143.88 35.31 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 115.507 -0.769 . . . . 73.1 108.926 -176.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 447' ' ' ILE . . . . . 0.45 HD11 ' SD ' ' A' ' 495' ' ' MET . 3.2 mt -120.95 148.49 24.17 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.79 0 C-N-CA 123.758 0.823 . . . . 71.33 110.09 -176.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -126.58 122.52 35.3 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 107.254 -1.388 . . . . 74.15 107.254 176.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.595 HD22 HG22 ' A' ' 520' ' ' VAL . 27.5 mt -108.55 153.71 22.98 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.267 -0.642 . . . . 64.43 109.267 -175.156 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 450' ' ' ARG . . . . . 0.426 ' HD2' ' OE2' ' A' ' 519' ' ' GLU . 32.6 ttm180 -142.15 147.56 36.85 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 107.402 -1.332 . . . . 61.4 107.402 172.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 86.24 34.61 12.08 Favored Glycine 0 C--N 1.306 -1.124 0 C-N-CA 120.304 -0.95 . . . . 61.53 114.045 175.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 86.4 mt -82.3 142.34 47.01 Favored Pre-proline 0 C--N 1.302 -1.476 0 N-CA-C 109.015 -0.735 . . . . 74.42 109.015 174.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.58 163.74 2.56 Favored 'Trans proline' 0 C--O 1.252 1.221 0 C-N-CA 123.126 2.551 . . . . 75.53 112.721 176.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -71.95 93.48 1.36 Allowed 'General case' 0 N--CA 1.412 -2.35 0 CA-C-N 114.538 -1.21 . . . . 74.33 110.094 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 78.66 36.46 0.19 Allowed 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 112.105 -2.316 . . . . 53.33 111.815 171.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -57.51 130.95 48.63 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.924 -1.139 . . . . 62.02 107.924 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.89 164.63 26.35 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-O 120.827 0.346 . . . . 41.55 110.439 -173.694 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.443 ' O ' HG22 ' A' ' 461' ' ' ILE . 61.0 mt -62.44 -35.43 69.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.848 0.832 . . . . 73.4 109.686 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -69.17 -29.96 68.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.762 -0.654 . . . . 61.14 110.512 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.62 -39.15 70.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.431 -0.804 . . . . 74.04 110.657 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.4 tt -74.99 -33.41 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 116.237 -0.438 . . . . 55.14 110.455 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.26 -36.2 79.05 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.236 0.541 . . . . 74.4 110.059 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -61.11 -50.96 71.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.026 -0.988 . . . . 73.43 108.886 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -55.73 -38.85 70.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 113.847 -1.524 . . . . 62.43 111.739 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 87.1 mt -64.42 -35.27 80.36 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.114 -0.494 . . . . 62.14 111.901 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 68.52 -132.65 27.42 Favored Glycine 0 CA--C 1.48 -2.102 0 C-N-CA 119.776 -1.202 . . . . 51.41 112.685 178.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.97 -32.3 45.41 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.131 -1.035 . . . . 73.13 112.242 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -69.34 -14.38 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.083 0.468 . . . . 72.14 111.88 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 469' ' ' ALA . . . . . 0.492 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -69.96 -15.45 63.04 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.016 0.436 . . . . 65.42 110.596 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 21.0 m -77.11 -24.05 51.75 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 122.237 -0.289 . . . . 74.22 111.757 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 471' ' ' ASP . . . . . 0.433 ' OD2' ' HB3' ' A' ' 496' ' ' LYS . 30.6 t70 -106.2 -3.13 21.71 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.946 -0.471 . . . . 72.45 111.728 -178.054 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 472' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 469' ' ' ALA . 10.6 tt -59.84 146.11 10.63 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 CA-C-O 120.928 0.394 . . . . 54.33 110.771 -176.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 473' ' ' ARG . . . . . 0.454 ' NH2' ' HA ' ' A' ' 496' ' ' LYS . 15.2 tpp180 -74.1 139.38 44.56 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 105.773 -1.936 . . . . 73.25 105.773 175.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 21.4 m -72.03 116.42 12.42 Favored 'General case' 0 C--N 1.278 -2.536 0 N-CA-C 109.655 -0.498 . . . . 72.33 109.655 -173.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 9.6 m170 67.19 21.93 9.88 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.789 0.835 . . . . 72.03 111.554 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.79 -6.06 88.81 Favored Glycine 0 N--CA 1.439 -1.12 0 CA-C-N 115.252 -0.886 . . . . 61.3 111.316 177.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.4 p -84.44 119.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 CA-C-O 121.169 0.509 . . . . 60.21 109.921 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -134.69 120.52 19.6 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.05 -0.722 . . . . 72.44 109.05 -178.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 65.8 mtt -97.59 147.75 23.98 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 108.243 -1.021 . . . . 73.42 108.243 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.1 t -94.95 109.46 22.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 CA-C-O 121.602 0.715 . . . . 53.44 110.671 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 487' ' ' PRO . 2.9 mp -98.87 146.49 25.91 Favored 'General case' 0 N--CA 1.427 -1.598 0 N-CA-C 107.545 -1.279 . . . . 64.34 107.545 172.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -90.08 -179.82 5.76 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.826 -1.546 . . . . 71.25 106.826 -175.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.9 -16.35 64.26 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 114.371 1.248 . . . . 64.34 114.371 -173.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -81.61 -10.08 59.52 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.515 0.674 . . . . 70.43 109.484 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.72 32.1 25.2 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.513 -0.767 . . . . 75.23 111.589 -177.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 30.3 mmt180 -119.31 131.87 24.2 Favored Pre-proline 0 C--N 1.309 -1.193 0 N-CA-C 107.959 -1.126 . . . . 74.12 107.959 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 487' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 481' ' ' LEU . 51.4 Cg_exo -57.47 129.76 35.57 Favored 'Trans proline' 0 C--O 1.243 0.76 0 C-N-CA 122.226 1.951 . . . . 74.11 111.205 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 8.0 p -73.95 -28.44 61.5 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.83 0.824 . . . . 72.53 108.982 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 120.72 -15.08 9.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 114.89 -1.05 . . . . 65.22 111.455 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -100.39 161.37 13.64 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 120.932 0.396 . . . . 71.14 110.155 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -159.38 177.56 10.85 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.923 -0.581 . . . . 73.52 109.818 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -135.12 143.03 46.35 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 124.566 1.147 . . . . 71.13 108.657 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 53.7 mt -139.73 135.77 39.17 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 N-CA-C 107.143 -1.429 . . . . 53.54 107.143 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -111.59 138.48 48.07 Favored 'General case' 0 C--N 1.272 -2.785 0 C-N-CA 118.934 -1.106 . . . . 75.02 108.415 175.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.45 ' SD ' HD11 ' A' ' 447' ' ' ILE . 79.0 mtp -104.71 -176.75 3.17 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.724 -0.843 . . . . 61.14 108.724 175.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.454 ' HA ' ' NH2' ' A' ' 473' ' ' ARG . 3.2 ttmp? -88.21 -39.31 14.57 Favored 'General case' 0 C--N 1.281 -2.384 0 CA-C-O 121.338 0.589 . . . . 61.04 109.642 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 15.6 m -114.26 141.67 47.27 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 115.1 -0.954 . . . . 74.22 111.502 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.11 67.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.207 -0.906 . . . . 62.24 109.02 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -67.27 -45.69 75.87 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-N 114.813 -1.085 . . . . 61.2 110.544 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -70.76 -36.19 72.98 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.507 -0.77 . . . . 70.35 110.346 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -61.67 -41.46 97.57 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 123.551 0.532 . . . . 70.14 110.331 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -62.24 -43.69 98.26 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.918 -0.583 . . . . 71.33 110.935 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 89.7 mtp -65.05 -41.24 95.35 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.172 -0.467 . . . . 74.05 110.516 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.81 -42.53 94.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.145 -0.48 . . . . 61.52 110.461 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.05 -38.49 85.92 Favored 'General case' 0 C--O 1.195 -1.807 0 CA-C-N 116.134 -0.484 . . . . 63.22 111.056 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.95 -42.84 72.7 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.476 0.655 . . . . 72.45 110.072 178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -68.29 -34.31 75.93 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.668 -0.696 . . . . 61.41 110.55 -177.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 34.7 m -115.1 19.01 16.0 Favored 'General case' 0 N--CA 1.425 -1.714 0 N-CA-C 112.993 0.738 . . . . 71.51 112.993 -174.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 509' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 34.7 t-80 -69.23 93.51 0.62 Allowed 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.511 -0.743 . . . . 71.24 110.299 176.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.407 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 45.6 tttp 71.0 30.04 2.83 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.399 1.479 . . . . 65.15 109.717 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.08 141.91 40.03 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.25 -1.341 . . . . 61.14 108.919 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -77.63 145.79 36.53 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-O 121.256 0.551 . . . . 65.42 110.797 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -129.77 102.17 6.21 Favored 'General case' 0 C--N 1.288 -2.091 0 N-CA-C 106.35 -1.722 . . . . 54.13 106.35 173.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 66.1 -81.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 124.712 1.205 . . . . 63.45 111.958 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -134.76 -2.37 2.66 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 123.399 0.68 . . . . 64.21 112.07 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -115.02 161.39 18.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 107.784 -1.191 . . . . 73.01 107.784 -176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -113.36 121.43 44.33 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.705 -0.479 . . . . 75.43 109.705 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 59.2 t -99.11 112.76 32.11 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.183 0 O-C-N 124.161 0.913 . . . . 71.45 108.638 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 519' ' ' GLU . . . . . 0.426 ' OE2' ' HD2' ' A' ' 450' ' ' ARG . 49.7 mt-10 -96.29 112.71 24.36 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.146 -1.057 . . . . 71.42 108.146 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 520' ' ' VAL . . . . . 0.595 HG22 HD22 ' A' ' 449' ' ' LEU . 93.6 t -104.38 115.6 46.59 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.24 0 CA-C-N 115.382 -0.827 . . . . 71.21 109.602 -177.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.99 147.94 32.56 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 108.491 -0.929 . . . . 73.31 108.491 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -105.34 153.36 21.74 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.259 -1.015 . . . . 72.13 108.259 -178.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.8 p -162.79 168.77 20.94 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.259 0.552 . . . . 72.35 111.906 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.595 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 69.3 m -91.9 160.14 15.43 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-N 115.359 -0.837 . . . . 62.32 112.444 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -51.73 -36.31 46.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.675 -1.148 . . . . 72.15 111.667 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -64.59 -51.14 64.27 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 108.967 -0.753 . . . . 73.23 108.967 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -39.08 90.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.024 -0.535 . . . . 71.22 111.101 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 528' ' ' MET . . . . . 0.512 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.2 ttt -66.81 -45.15 79.26 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.906 -0.588 . . . . 73.3 110.499 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -71.73 -31.56 66.83 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.806 -0.442 . . . . 75.51 109.806 -176.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -61.31 -47.37 86.24 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 123.899 0.88 . . . . 75.11 110.588 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 48.4 t -70.39 -35.09 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.332 -0.547 . . . . 72.2 109.588 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 532' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.2 mt . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.195 -0.457 . . . . 63.52 110.822 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.3 t . . . . . 0 C--O 1.245 0.828 0 N-CA-C 109.537 -0.542 . . . . 71.4 109.537 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.54 ' HG3' ' OG ' ' A' ' 524' ' ' SER . 7.6 mpt_? -102.28 67.02 1.02 Allowed 'General case' 0 C--O 1.209 -1.059 0 N-CA-C 110.026 -0.361 . . . . 73.14 110.026 -176.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -124.82 14.87 8.63 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 112.592 0.59 . . . . 63.11 112.592 -176.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 20.4 m -108.84 151.64 25.98 Favored 'General case' 0 N--CA 1.413 -2.284 0 N-CA-C 108.462 -0.94 . . . . 21.42 108.462 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.81 132.55 69.96 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.722 0 N-CA-C 108.655 -0.868 . . . . 71.32 108.655 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -106.02 121.41 44.07 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 108.356 -0.979 . . . . 75.12 108.356 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 449' ' ' LEU . . . . . 0.437 HD22 HG22 ' A' ' 520' ' ' VAL . 18.3 mt -104.45 150.44 24.56 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.684 -1.228 . . . . 72.2 107.684 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 450' ' ' ARG . . . . . 0.412 HH21 ' CD ' ' A' ' 519' ' ' GLU . 60.6 ttp180 -146.52 131.63 18.32 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.853 -0.425 . . . . 73.03 109.853 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.32 41.06 2.12 Favored Glycine 0 C--N 1.289 -2.036 0 CA-C-N 115.737 -0.665 . . . . 65.54 111.653 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.06 130.85 89.38 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.16 . . . . 64.05 111.388 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 453' ' ' PRO . . . . . 0.506 ' HB2' ' HB2' ' A' ' 456' ' ' ALA . 37.6 Cg_exo -58.91 156.83 31.39 Favored 'Trans proline' 0 N--CA 1.447 -1.216 0 C-N-CA 122.808 2.339 . . . . 74.32 112.67 176.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -78.14 93.11 4.5 Favored 'General case' 0 N--CA 1.408 -2.537 0 CA-C-N 114.103 -1.408 . . . . 74.31 110.006 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.83 25.76 0.03 OUTLIER 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 112.732 -2.031 . . . . 72.41 113.325 172.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 456' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 453' ' ' PRO . . . -69.39 135.87 50.9 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.375 -1.342 . . . . 72.15 107.375 172.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.2 p -89.26 174.7 7.69 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-O 120.884 0.373 . . . . 73.43 111.795 -175.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.454 ' HA ' HG22 ' A' ' 461' ' ' ILE . 72.8 mt -61.48 -38.05 79.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 N-CA-C 108.886 -0.783 . . . . 71.52 108.886 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -64.73 -37.3 87.14 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.403 -0.817 . . . . 72.32 110.714 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -68.75 -43.4 75.92 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.061 0.458 . . . . 60.3 110.437 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 465' ' ' LEU . 12.6 tt -71.85 -33.0 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 CA-C-N 115.839 -0.619 . . . . 53.34 110.621 -175.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.424 ' HG ' ' HB1' ' A' ' 469' ' ' ALA . 8.1 mp -70.8 -30.64 67.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.9 0.381 . . . . 75.52 110.9 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.93 -48.23 66.53 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.207 -1.035 . . . . 61.32 108.207 175.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -54.63 -42.74 71.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.17 -1.377 . . . . 75.33 111.102 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 465' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 90.0 mt -64.95 -31.66 73.01 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.811 -0.631 . . . . 72.22 111.811 178.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 85.83 -149.41 23.28 Favored Glycine 0 N--CA 1.422 -2.268 0 C-N-CA 120.51 -0.852 . . . . 72.51 111.431 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -66.31 -22.52 66.28 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.031 -0.585 . . . . 63.41 111.005 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -62.81 -17.44 61.24 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.808 -0.633 . . . . 74.15 111.101 178.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 469' ' ' ALA . . . . . 0.424 ' HB1' ' HG ' ' A' ' 462' ' ' LEU . . . -67.44 -15.32 63.61 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 116.059 -0.519 . . . . 72.54 110.979 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.3 m -85.83 -3.27 58.87 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.759 0.79 . . . . 65.31 109.508 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 471' ' ' ASP . . . . . 0.439 ' CG ' ' HE ' ' A' ' 500' ' ' ARG . 3.8 m-20 -112.93 13.95 19.65 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.996 -0.547 . . . . 74.32 110.771 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 15.8 tt -72.07 150.63 8.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.282 -0.872 . . . . 72.4 109.017 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -80.34 151.84 29.26 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 109.542 -0.54 . . . . 72.12 109.542 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 1.4 m -59.24 114.41 2.63 Favored 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.881 1.273 . . . . 74.4 109.704 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 59.93 33.21 21.46 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.746 0.818 . . . . 72.55 110.726 -178.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -98.35 37.04 3.64 Favored Glycine 0 N--CA 1.432 -1.584 0 CA-C-N 116.059 -0.519 . . . . 73.13 114.32 -174.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 59.0 t -118.41 111.47 34.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.304 0 N-CA-C 109.016 -0.735 . . . . 71.11 109.016 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 29.9 m-70 -127.65 100.47 5.99 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.243 0.544 . . . . 62.21 111.396 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 479' ' ' MET . . . . . 0.408 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 66.7 mtt -82.61 142.75 31.51 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.907 -0.775 . . . . 71.34 108.907 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 46.9 t -88.01 107.49 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.685 0 N-CA-C 107.214 -1.402 . . . . 62.22 107.214 176.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.8 pp -93.11 158.51 15.74 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.626 -0.715 . . . . 74.44 112.458 -178.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -91.93 173.2 7.97 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 106.342 -1.725 . . . . 75.13 106.342 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -56.05 -27.46 53.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.184 0.447 . . . . 71.44 111.219 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' GLN . . . . . 0.435 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 35.3 tt0 -69.41 -20.23 63.8 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 121.161 0.505 . . . . 72.45 111.345 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 90.87 25.58 24.49 Favored Glycine 0 N--CA 1.435 -1.403 0 CA-C-O 121.463 0.48 . . . . 13.55 112.898 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.435 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 91.3 mtt180 -126.79 144.78 51.2 Favored Pre-proline 0 C--N 1.303 -1.445 0 N-CA-C 108.037 -1.097 . . . . 70.54 108.037 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -53.17 136.18 61.26 Favored 'Trans proline' 0 C--O 1.245 0.868 0 C-N-CA 123.113 2.542 . . . . 75.32 113.055 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.2 m -80.01 1.58 27.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.461 -0.79 . . . . 62.11 111.142 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.85 -30.0 6.57 Favored Glycine 0 CA--C 1.488 -1.656 0 N-CA-C 111.235 -0.746 . . . . 72.03 111.235 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -107.22 152.84 23.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.06 0.457 . . . . 70.41 110.86 179.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.408 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -158.11 169.38 24.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.498 -0.774 . . . . 61.23 109.184 -176.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -127.71 129.88 47.87 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-N 116.182 -0.463 . . . . 60.44 109.775 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 43.3 mt -122.27 133.01 69.85 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.378 0 N-CA-C 105.977 -1.86 . . . . 74.34 105.977 172.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -108.54 136.57 47.92 Favored 'General case' 0 C--N 1.271 -2.812 0 N-CA-C 109.571 -0.529 . . . . 74.52 109.571 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.72 172.59 6.72 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 123.214 0.606 . . . . 62.13 111.442 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -65.07 -43.93 90.58 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.179 0.991 . . . . 75.13 110.181 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 51.0 p -141.03 155.98 46.09 Favored 'General case' 0 N--CA 1.42 -1.943 0 CA-C-N 116.302 -0.408 . . . . 73.5 111.785 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.54 -40.88 93.14 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.02 -0.991 . . . . 72.34 111.392 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.56 -37.84 87.85 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.093 -0.958 . . . . 71.43 111.932 -174.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 500' ' ' ARG . . . . . 0.439 ' HE ' ' CG ' ' A' ' 471' ' ' ASP . 26.0 mmm180 -75.94 -40.77 53.39 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.405 -0.816 . . . . 71.4 109.741 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.34 -41.84 98.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.362 -0.835 . . . . 70.45 111.008 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 502' ' ' PHE . . . . . 0.404 ' HA ' ' HG3' ' A' ' 522' ' ' GLN . 66.1 t80 -64.6 -40.06 94.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.855 -0.611 . . . . 72.5 110.978 -178.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 55.6 ttm -70.32 -37.63 74.76 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.303 -0.559 . . . . 65.11 110.304 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.004 -0.544 . . . . 34.32 110.644 178.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.14 -32.18 70.04 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.076 -0.511 . . . . 74.23 111.836 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -72.89 -34.8 66.91 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.335 0.588 . . . . 55.33 109.772 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -68.69 -41.7 78.81 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.438 -0.801 . . . . 73.44 110.778 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 62.2 m -105.5 20.68 18.48 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 112.558 0.577 . . . . 71.13 112.558 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.89 92.32 0.23 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.384 0.611 . . . . 63.23 110.572 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 82.7 tttt 64.31 62.74 0.81 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.501 1.52 . . . . 74.41 110.041 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -105.82 139.38 40.48 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 113.429 -1.714 . . . . 64.45 107.763 179.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 517' ' ' TYR . 3.2 p-10 -75.78 140.72 42.5 Favored 'General case' 0 C--N 1.293 -1.879 0 CA-C-O 121.216 0.532 . . . . 72.24 111.268 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.7 ttt -126.19 90.68 3.23 Favored 'General case' 0 N--CA 1.415 -2.19 0 N-CA-C 105.576 -2.009 . . . . 75.44 105.576 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp 68.55 -84.86 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.928 -1.487 . . . . 72.44 110.573 -177.045 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -107.35 -35.87 6.67 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 115.966 -0.561 . . . . 74.54 112.082 -177.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.4 ttm105 -108.63 153.1 23.89 Favored 'General case' 0 C--N 1.273 -2.76 0 CA-C-N 114.992 -1.003 . . . . 65.0 109.833 -165.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 517' ' ' TYR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 512' ' ' ASN . 7.6 p90 -101.2 121.29 41.58 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 121.219 0.533 . . . . 70.53 112.083 -177.307 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.55 109.97 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.277 0 CA-C-N 114.887 -1.052 . . . . 53.45 108.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 519' ' ' GLU . . . . . 0.412 ' CD ' HH21 ' A' ' 450' ' ' ARG . 37.2 mt-10 -89.41 110.86 21.63 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 107.808 -1.182 . . . . 64.2 107.808 178.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 520' ' ' VAL . . . . . 0.437 HG22 HD22 ' A' ' 449' ' ' LEU . 85.5 t -104.4 123.43 58.27 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.143 0 CA-C-N 115.874 -0.603 . . . . 73.03 109.501 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -122.07 135.32 54.8 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.006 -0.739 . . . . 65.14 109.006 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 522' ' ' GLN . . . . . 0.404 ' HG3' ' HA ' ' A' ' 502' ' ' PHE . 0.0 OUTLIER -90.85 125.63 35.79 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 106.828 -1.545 . . . . 52.2 106.828 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 62.4 m -134.49 170.31 15.95 Favored 'General case' 0 C--N 1.284 -2.24 0 CA-C-N 115.348 -0.842 . . . . 50.42 111.014 -171.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.54 ' OG ' ' HG3' ' A' ' 444' ' ' ARG . 44.4 m -92.69 164.1 13.52 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 116.278 -0.419 . . . . 50.24 110.721 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.91 -23.05 63.19 Favored 'General case' 0 C--O 1.209 -1.063 0 CA-C-N 115.552 -0.749 . . . . 73.21 111.056 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.55 -50.31 70.0 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.146 -0.479 . . . . 72.4 110.379 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.6 -40.59 95.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.185 0.517 . . . . 70.12 110.607 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 528' ' ' MET . . . . . 0.506 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 27.8 ttt -67.01 -44.43 80.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.631 -0.713 . . . . 70.35 110.417 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.13 -35.95 80.82 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-N 116.12 -0.491 . . . . 71.41 110.164 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -62.73 -46.2 89.17 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.983 -0.553 . . . . 72.31 110.664 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 58.4 t -74.35 -31.79 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 120.327 -0.549 . . . . 73.1 110.911 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 532' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 528' ' ' MET . 73.3 mt . . . . . 0 C--N 1.322 -0.61 0 CA-C-O 120.909 0.385 . . . . 74.44 110.869 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.437 -1.076 0 N-CA-C 109.522 -0.548 . . . . 72.11 109.522 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 444' ' ' ARG . . . . . 0.522 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 22.1 ptt180 -87.25 51.91 2.36 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 122.545 1.164 . . . . 75.14 109.525 176.222 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -101.93 9.25 40.72 Favored 'General case' 0 C--N 1.3 -1.543 0 CA-C-N 114.144 -1.389 . . . . 75.23 111.288 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 44.3 m -107.54 149.36 28.09 Favored 'General case' 0 N--CA 1.412 -2.351 0 C-N-CA 119.559 -0.857 . . . . 65.03 109.948 -176.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 447' ' ' ILE . . . . . 0.664 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.5 mt -122.08 141.47 42.36 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.936 0 N-CA-C 106.892 -1.522 . . . . 71.05 106.892 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -116.63 124.94 51.01 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 108.101 -1.074 . . . . 74.14 108.101 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.6 mt -108.88 125.46 52.02 Favored 'General case' 0 C--N 1.279 -2.483 0 N-CA-C 106.038 -1.838 . . . . 70.42 106.038 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -136.52 137.26 40.11 Favored 'General case' 0 C--N 1.274 -2.709 0 CA-C-O 121.32 0.581 . . . . 54.15 110.372 -176.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 95.08 23.0 21.36 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 110.279 -1.128 . . . . 61.54 110.279 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.9 mt -60.11 145.46 85.15 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 123.899 0.88 . . . . 72.41 111.932 -178.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -59.98 158.96 27.3 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 C-N-CA 122.836 2.357 . . . . 61.45 113.707 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -77.17 95.1 4.2 Favored 'General case' 0 N--CA 1.396 -3.161 0 CA-C-N 113.004 -1.907 . . . . 75.34 109.683 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 87.74 26.84 0.04 OUTLIER 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 112.362 -2.199 . . . . 71.33 112.926 171.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -67.55 136.2 54.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.579 -0.737 . . . . 60.02 109.228 173.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 5.8 p -85.68 151.9 23.51 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 115.663 -0.699 . . . . 74.45 109.574 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 458' ' ' ILE . . . . . 0.621 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.253 2.7 pp -62.3 -29.66 47.17 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.763 0 C-N-CA 120.003 -0.679 . . . . 73.34 112.606 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.86 -29.42 67.73 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.884 0.374 . . . . 70.42 111.224 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -75.51 -40.09 57.57 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.929 -0.767 . . . . 60.43 108.929 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' ILE . . . . . 0.443 HG22 ' HA ' ' A' ' 458' ' ' ILE . 12.4 tt -75.07 -28.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 C-N-CA 120.137 -0.625 . . . . 52.23 111.07 -179.069 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 87.0 mt -63.62 -34.84 78.71 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.676 -0.49 . . . . 75.2 109.676 175.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.19 -48.54 70.33 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.341 -0.985 . . . . 72.33 108.341 176.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.74 -41.18 70.09 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 113.992 -1.458 . . . . 72.34 111.2 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 97.0 mt -69.65 -37.39 76.73 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.013 -0.539 . . . . 75.52 110.325 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 87.29 -146.65 20.36 Favored Glycine 0 N--CA 1.418 -2.509 0 C-N-CA 120.758 -0.734 . . . . 63.24 112.97 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -49.75 -30.54 9.66 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 126.343 1.857 . . . . 73.04 113.275 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -61.62 -19.58 62.41 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.38 0.672 . . . . 72.51 112.368 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -61.9 -15.29 41.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.213 0.82 . . . . 72.42 113.213 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 12.8 t -86.58 -15.02 41.16 Favored 'General case' 0 CA--C 1.551 1.012 0 O-C-N 121.694 -0.629 . . . . 53.0 111.548 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 471' ' ' ASP . . . . . 0.403 ' HB3' ' CE ' ' A' ' 495' ' ' MET . 36.9 t70 -102.42 13.44 34.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.167 0.984 . . . . 51.3 110.469 -174.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 11.2 tt -73.53 152.62 7.31 Favored 'Isoleucine or valine' 0 C--O 1.248 1.013 0 CA-C-N 115.195 -0.911 . . . . 72.33 109.202 177.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -83.87 144.59 29.13 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 119.836 -0.745 . . . . 64.22 109.126 173.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 20.4 m -59.9 119.31 7.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.783 -0.821 . . . . 72.24 108.783 176.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 36.2 t-80 68.11 21.55 8.65 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.305 1.05 . . . . 64.24 109.257 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.75 -15.99 80.5 Favored Glycine 0 N--CA 1.438 -1.176 0 CA-C-N 115.512 -0.767 . . . . 63.0 112.296 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -83.67 123.81 39.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.445 0.641 . . . . 62.43 110.404 178.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -133.24 117.12 17.02 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.674 -0.861 . . . . 74.11 108.674 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.0 mtt -91.87 145.5 24.5 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-O 120.676 0.274 . . . . 64.23 110.341 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.9 t -84.61 96.33 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.545 0 N-CA-C 105.74 -1.948 . . . . 74.5 105.74 172.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.3 pp -96.03 161.42 13.99 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 114.209 -1.36 . . . . 71.32 113.356 -176.009 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.02 162.98 16.52 Favored 'General case' 0 C--N 1.282 -2.336 0 N-CA-C 104.098 -2.556 . . . . 71.24 104.098 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 64.3 m80 -70.31 -5.16 25.92 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 119.788 1.176 . . . . 72.25 112.411 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -83.39 -7.02 59.63 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.073 -0.967 . . . . 75.31 109.143 172.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 81.29 29.15 41.68 Favored Glycine 0 CA--C 1.495 -1.218 0 CA-C-N 115.746 -0.661 . . . . 55.44 112.859 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -117.43 127.41 26.69 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 108.669 -0.863 . . . . 61.32 108.669 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.78 126.63 19.39 Favored 'Trans proline' 0 C--O 1.243 0.772 0 C-N-CA 122.347 2.032 . . . . 52.23 111.197 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.6 m -74.95 -2.14 25.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.892 -0.594 . . . . 71.4 112.068 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 107.56 10.93 26.19 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.88 -0.676 . . . . 54.43 111.737 179.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -132.25 138.31 47.86 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.168 -1.419 . . . . 63.15 107.168 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.17 161.37 30.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.868 0.366 . . . . 45.11 110.73 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -122.9 142.81 50.39 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 123.3 0.64 . . . . 72.24 109.3 177.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 60.8 mt -128.62 126.5 65.37 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.228 0 N-CA-C 107.491 -1.299 . . . . 53.43 107.491 174.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -100.19 126.36 46.46 Favored 'General case' 0 C--N 1.275 -2.648 0 N-CA-C 109.539 -0.541 . . . . 51.31 109.539 177.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 495' ' ' MET . . . . . 0.664 ' SD ' HD11 ' A' ' 447' ' ' ILE . 82.9 mtp -100.47 170.38 8.43 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 108.364 -0.976 . . . . 74.44 108.364 177.478 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -80.82 -35.59 32.72 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.4 -0.592 . . . . 72.43 109.4 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.5 m -122.06 141.36 51.46 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-O 121.469 0.652 . . . . 73.13 111.205 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -76.18 -22.71 55.0 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.9 . . . . 71.44 111.84 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -70.97 -40.93 71.64 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.782 -0.644 . . . . 73.25 110.753 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -38.41 67.2 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.279 -0.873 . . . . 75.0 111.753 173.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 501' ' ' ALA . . . . . 0.418 ' HA ' ' SD ' ' A' ' 495' ' ' MET . . . -57.81 -44.73 86.54 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.196 0.522 . . . . 53.52 110.779 178.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -63.13 -39.2 94.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.631 -0.713 . . . . 70.21 110.426 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.85 -34.99 72.21 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.64 0.237 . . . . 75.04 111.64 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.15 -43.24 82.83 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.56 -0.533 . . . . 64.14 109.56 177.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -66.45 -29.67 69.85 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.897 -0.592 . . . . 74.23 110.901 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -71.52 -44.69 64.17 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.458 -0.571 . . . . 63.3 109.458 177.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.2 -44.51 96.42 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.611 -0.722 . . . . 73.44 110.347 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 58.9 m -98.71 10.44 41.14 Favored 'General case' 0 N--CA 1.421 -1.907 0 N-CA-C 113.513 0.931 . . . . 34.12 113.513 -173.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 509' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 32.7 t60 -77.06 104.35 7.5 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 119.439 -0.904 . . . . 73.23 109.453 174.097 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 73.01 19.43 3.7 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.72 1.208 . . . . 74.43 110.617 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.02 146.67 26.55 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.502 -1.296 . . . . 70.01 107.502 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -98.04 149.52 22.38 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 118.666 -1.214 . . . . 75.2 111.673 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.0 ttt -120.17 113.0 19.79 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 104.946 -2.242 . . . . 52.33 104.946 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.3 mttm 69.99 -87.19 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.118 -1.067 . . . . 72.33 108.118 -172.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.25 1.53 1.24 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.314 0.646 . . . . 74.41 111.417 175.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -103.99 142.58 34.19 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 107.566 -1.272 . . . . 71.22 107.566 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -95.24 125.35 39.82 Favored 'General case' 0 C--N 1.265 -3.077 0 CA-C-O 121.489 0.661 . . . . 73.31 110.7 -176.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 61.4 t -102.23 127.39 55.84 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.666 0 N-CA-C 106.881 -1.525 . . . . 72.2 106.881 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -103.77 109.21 20.84 Favored 'General case' 0 N--CA 1.411 -2.404 0 N-CA-C 108.221 -1.029 . . . . 75.44 108.221 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.0 t -106.73 134.28 48.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 CA-C-N 115.15 -0.932 . . . . 61.43 110.623 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -125.33 159.9 30.63 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.437 -0.949 . . . . 73.53 108.437 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 522' ' ' GLN . . . . . 0.515 ' OE1' ' HB2' ' A' ' 444' ' ' ARG . 0.7 OUTLIER -101.68 139.49 37.25 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.392 -1.336 . . . . 40.1 107.392 177.482 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 65.1 m -141.01 169.47 17.54 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.86 0.362 . . . . 62.41 110.724 -175.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.3 p -99.2 159.96 14.61 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.999 -0.546 . . . . 62.43 109.931 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -56.99 -30.88 64.52 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 123.614 0.571 . . . . 63.41 109.646 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.36 -52.56 57.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.377 1.071 . . . . 55.04 110.068 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -59.68 -42.81 93.75 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.675 0.75 . . . . 73.34 109.076 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 22.1 ttt -62.01 -45.04 95.33 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 114.586 -1.188 . . . . 74.52 110.199 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.99 -39.3 87.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.938 -0.573 . . . . 65.42 109.761 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -68.31 -39.12 82.12 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.079 -0.509 . . . . 71.34 110.764 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 91.5 t -73.3 -38.11 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 C-N-CA 120.233 -0.587 . . . . 63.13 110.469 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 121.204 0.526 . . . . 70.23 111.772 -178.726 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 CA--C 1.513 -0.459 0 N-CA-C 108.034 -1.099 . . . . 61.34 108.034 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 439' ' ' PRO . . . . . 0.407 ' HA ' ' HD3' ' A' ' 440' ' ' PRO . 45.9 Cg_endo -71.13 127.26 13.29 Favored 'Trans proline' 0 C--O 1.248 1.021 0 C-N-CA 121.858 1.705 . . . . 65.1 111.594 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 440' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 439' ' ' PRO . 33.7 Cg_exo -60.71 107.02 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.454 2.103 . . . . 53.23 110.419 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 25.8 m -97.61 131.57 44.07 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-N 115.742 -0.663 . . . . 74.24 109.414 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 442' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' A' ' 524' ' ' SER . 51.9 t30 -80.34 95.94 6.52 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.493 -0.558 . . . . 75.45 109.493 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 30.3 t -108.87 153.53 10.56 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 107.401 -1.333 . . . . 55.33 107.401 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.563 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 59.0 mtp85 -90.06 62.25 5.49 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 121.851 0.834 . . . . 74.51 109.813 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.2 p30 -111.43 11.73 21.46 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-N 115.005 -0.998 . . . . 71.41 110.168 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 494' ' ' GLN . 28.3 m -109.07 151.28 26.6 Favored 'General case' 0 N--CA 1.408 -2.539 0 N-CA-C 107.797 -1.186 . . . . 64.32 107.797 -177.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 447' ' ' ILE . . . . . 0.441 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.2 mt -132.13 143.9 38.7 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.39 0 N-CA-C 108.354 -0.98 . . . . 64.01 108.354 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -112.29 119.1 37.16 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 108.056 -1.09 . . . . 64.13 108.056 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 10.6 mt -94.42 141.5 28.51 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.505 -2.035 . . . . 71.13 105.505 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' ARG . . . . . 0.47 ' HE ' ' CG ' ' A' ' 490' ' ' ASP . 0.0 OUTLIER -142.65 135.83 28.48 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 119.53 -0.868 . . . . 75.02 109.861 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 450' ' ' ARG . . . 99.51 22.26 13.03 Favored Glycine 0 C--N 1.28 -2.576 0 CA-C-N 114.474 -1.239 . . . . 74.12 112.188 177.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.75 144.59 96.35 Favored Pre-proline 0 C--O 1.242 0.66 0 C-N-CA 122.883 0.473 . . . . 70.41 111.974 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -57.21 160.65 12.73 Favored 'Trans proline' 0 C--O 1.252 1.218 0 C-N-CA 123.395 2.73 . . . . 64.01 113.762 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -77.19 98.61 5.15 Favored 'General case' 0 N--CA 1.401 -2.903 0 CA-C-N 113.952 -1.476 . . . . 70.34 108.686 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.96 30.43 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.485 0 CA-C-N 111.966 -2.379 . . . . 65.51 111.971 172.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -54.2 121.87 9.09 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 108.425 -0.954 . . . . 62.34 108.425 171.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 7.2 p -81.02 169.35 17.61 Favored 'General case' 0 N--CA 1.414 -2.27 0 CA-C-N 115.963 -0.562 . . . . 70.02 111.952 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.651 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 16.2 tt -67.1 -31.69 54.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 CA-C-N 116.185 -0.461 . . . . 72.12 111.957 -174.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -80.25 -28.19 38.52 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.74 -0.784 . . . . 73.42 110.264 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.62 -40.1 80.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.14 -0.936 . . . . 70.11 108.968 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.5 tt -71.01 -32.88 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 115.41 -0.814 . . . . 75.22 110.065 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 93.1 mt -68.25 -40.08 82.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.327 -0.249 . . . . 75.55 110.327 178.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.97 -52.43 64.2 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 121.502 0.667 . . . . 60.22 109.28 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -53.97 -39.4 65.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.905 -1.498 . . . . 70.42 111.878 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 465' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 94.7 mt -72.64 -36.49 68.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.915 -0.584 . . . . 61.44 111.92 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.82 -140.41 25.86 Favored Glycine 0 N--CA 1.43 -1.72 0 C-N-CA 119.85 -1.167 . . . . 52.34 111.855 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.46 -17.85 63.15 Favored 'General case' 0 C--N 1.287 -2.133 0 CA-C-N 114.603 -0.798 . . . . 75.04 113.017 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -70.6 -22.02 62.59 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.352 0.596 . . . . 75.45 110.899 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.4 -14.65 62.65 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.453 0.644 . . . . 73.43 110.521 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 15.9 m -81.68 -18.21 45.31 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 116.201 -0.454 . . . . 74.32 111.222 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -112.97 16.13 19.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.998 0.904 . . . . 74.42 110.672 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -66.81 145.58 13.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.879 0 CA-C-N 115.761 -0.654 . . . . 73.1 109.438 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -78.5 155.29 29.88 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.3 -1.37 . . . . 64.14 107.3 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 12.3 p -54.75 114.22 1.62 Allowed 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 123.426 0.69 . . . . 51.14 111.382 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 63.11 26.19 15.24 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.69 0.796 . . . . 51.24 111.968 -176.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.18 70.88 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 116.291 -0.413 . . . . 71.11 113.596 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.2 p -85.7 114.26 25.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.894 0.854 . . . . 73.12 112.245 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -124.78 113.76 18.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.079 -0.964 . . . . 73.15 109.508 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 66.1 mtt -88.94 136.97 32.73 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.924 -0.769 . . . . 74.14 108.924 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.61 121.12 37.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 N-CA-C 108.93 -0.767 . . . . 73.33 108.93 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 85.6 mt -92.95 158.7 15.68 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.756 -0.831 . . . . 75.43 108.756 179.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -106.6 -174.64 2.58 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.78 -1.563 . . . . 74.12 106.78 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -53.8 -39.96 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.771 0.828 . . . . 70.13 111.858 -176.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -68.68 -12.7 61.71 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.563 0.745 . . . . 63.44 111.993 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 84.48 24.21 47.76 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.454 -0.658 . . . . 75.22 111.454 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -127.86 152.86 77.85 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 106.937 -1.505 . . . . 72.43 106.937 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -50.55 135.12 40.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.308 2.672 . . . . 62.13 114.914 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 43.2 t -76.16 -18.75 58.97 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.662 -1.154 . . . . 73.13 109.11 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 102.09 -2.07 51.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 109.091 -1.603 . . . . 74.14 109.091 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' ASP . . . . . 0.47 ' CG ' ' HE ' ' A' ' 450' ' ' ARG . 8.6 m-20 -104.95 143.65 32.87 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 107.545 -1.279 . . . . 72.34 107.545 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -151.67 148.53 28.05 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 108.737 -0.838 . . . . 61.12 108.737 175.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' PHE . . . . . 0.413 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 70.1 m-85 -122.43 127.82 50.12 Favored 'General case' 0 C--N 1.282 -2.367 0 N-CA-C 108.692 -0.855 . . . . 73.35 108.692 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.6 mt -124.7 128.23 73.26 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 N-CA-C 109.053 -0.721 . . . . 72.24 109.053 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 446' ' ' CYS . 35.6 tt0 -102.55 123.82 46.98 Favored 'General case' 0 C--N 1.282 -2.363 0 N-CA-C 109.485 -0.561 . . . . 74.32 109.485 177.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.459 ' HE2' ' HB3' ' A' ' 500' ' ' ARG . 80.4 mtp -96.97 171.63 8.37 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.537 -0.756 . . . . 73.42 109.092 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -74.69 -38.29 62.43 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 121.284 0.564 . . . . 53.1 110.074 -177.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' SER . . . . . 0.422 ' HB2' ' HD3' ' A' ' 500' ' ' ARG . 1.7 m -115.63 141.12 48.49 Favored 'General case' 0 N--CA 1.403 -2.776 0 CA-C-N 115.432 -0.803 . . . . 71.54 110.039 -172.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -75.75 -25.04 56.16 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.334 0.587 . . . . 74.24 110.795 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.6 -40.9 55.74 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.603 -0.726 . . . . 74.3 109.45 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' ARG . . . . . 0.459 ' HB3' ' HE2' ' A' ' 495' ' ' MET . 8.7 mpt_? -63.16 -41.48 99.25 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.839 -1.073 . . . . 70.31 110.647 174.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -59.82 -44.03 94.25 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.503 0.502 . . . . 73.41 110.685 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 75.43 110.468 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 4.2 tpt -62.62 -41.62 99.12 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.005 -0.543 . . . . 75.52 109.845 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.37 -39.9 89.4 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.305 -0.407 . . . . 72.22 110.927 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.53 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -72.57 -22.87 60.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.345 -0.389 . . . . 64.5 111.912 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -82.57 -44.6 15.66 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 109.024 -0.732 . . . . 71.32 109.024 176.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.88 -43.24 96.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.722 -1.126 . . . . 71.44 110.045 -178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' CYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 62.8 m -101.6 13.68 34.22 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 115.208 -0.905 . . . . 54.12 112.985 -175.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 509' ' ' HIS . . . . . 0.53 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 25.3 t-80 -68.47 92.19 0.43 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.911 -0.774 . . . . 54.42 108.911 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.474 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 81.1 tttt 67.46 70.46 0.36 Allowed 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.871 1.668 . . . . 75.11 109.637 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 511' ' ' LYS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 87.1 tttt -105.21 148.08 27.32 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 113.274 -1.785 . . . . 51.2 108.363 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -84.3 117.61 23.67 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.85 -0.74 . . . . 73.44 109.623 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.446 ' SD ' HG21 ' A' ' 518' ' ' VAL . 26.3 ttt -108.37 95.37 5.62 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 106.935 -1.506 . . . . 63.52 106.935 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt 69.57 -79.39 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.335 1.022 . . . . 73.52 111.123 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -135.23 -3.65 2.43 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.944 0.878 . . . . 73.02 110.65 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -109.83 162.1 14.81 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.693 -0.855 . . . . 75.14 108.693 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -112.62 117.7 33.01 Favored 'General case' 0 N--CA 1.426 -1.653 0 N-CA-C 108.277 -1.009 . . . . 65.42 108.277 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' VAL . . . . . 0.446 HG21 ' SD ' ' A' ' 513' ' ' MET . 95.2 t -106.46 122.12 59.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.887 0 CA-C-N 114.901 -1.045 . . . . 73.23 108.563 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 519' ' ' GLU . . . . . 0.474 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 39.3 tt0 -99.2 114.35 27.1 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 108.434 -0.95 . . . . 71.21 108.434 -178.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 92.6 t -104.87 136.09 40.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 CA-C-N 114.998 -1.001 . . . . 62.01 109.777 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -135.29 141.86 45.76 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.514 -0.921 . . . . 72.01 108.514 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -76.66 154.69 34.03 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 109.452 -0.573 . . . . 72.33 109.452 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.8 m -152.36 169.28 22.92 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.291 0.567 . . . . 75.32 109.535 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 76.4 p -104.35 164.92 11.4 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 108.178 -1.045 . . . . 72.14 108.178 176.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -54.71 -39.06 67.8 Favored 'General case' 0 C--N 1.307 -1.265 0 O-C-N 123.734 0.646 . . . . 73.44 110.363 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -62.93 -47.19 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.949 -0.569 . . . . 71.12 110.567 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -63.21 -37.16 86.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.374 -0.376 . . . . 73.34 111.446 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 528' ' ' MET . . . . . 0.42 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.3 ttt -62.79 -48.37 79.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.923 -0.58 . . . . 51.41 110.314 177.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -68.36 -34.68 76.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.3 0.571 . . . . 73.14 109.994 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.29 -41.51 96.84 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.26 -0.882 . . . . 74.13 110.906 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 62.7 t -75.98 -35.0 28.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 C-N-CA 119.709 -0.796 . . . . 63.01 110.293 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 528' ' ' MET . 91.4 mt -67.76 -34.86 77.64 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 116.318 -0.401 . . . . 70.52 111.483 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 26.0 ttt -78.62 -18.25 54.8 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 122.036 0.922 . . . . 73.51 110.565 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 75.94 53.68 5.67 Favored Glycine 0 C--N 1.278 -2.663 0 CA-C-N 114.137 -1.392 . . . . 64.32 111.026 -176.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -64.0 164.48 31.95 Favored Glycine 0 N--CA 1.422 -2.282 0 CA-C-N 115.334 -0.433 . . . . 65.33 113.087 178.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 m -74.18 116.02 14.34 Favored 'General case' 0 N--CA 1.431 -1.379 0 C-N-CA 122.8 0.44 . . . . 75.21 110.342 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 61.4 tp -117.62 114.55 23.56 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 108.323 -0.991 . . . . 73.51 108.323 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -79.18 119.51 22.37 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 122.24 1.019 . . . . 75.42 112.052 -176.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 19.7 ttm180 -141.8 102.77 4.23 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 114.805 -1.089 . . . . 75.23 108.312 175.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.43 75.59 4.95 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 122.923 1.344 . . . . 73.24 111.567 177.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.43 -1.437 0 N-CA-C 106.605 -1.628 . . . . 73.1 106.605 -175.714 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.502 0 N-CA-C 107.75 -1.204 . . . . 71.52 107.75 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 439' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 440' ' ' PRO . 15.0 Cg_endo -59.13 137.66 80.58 Favored 'Trans proline' 0 C--O 1.241 0.648 0 C-N-CA 122.006 1.804 . . . . 64.51 110.611 176.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 440' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 439' ' ' PRO . 36.9 Cg_exo -58.32 111.95 1.02 Allowed 'Trans proline' 0 C--O 1.248 1.01 0 C-N-CA 122.444 2.096 . . . . 73.11 111.96 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.7 m -67.71 105.37 1.89 Allowed 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.763 -0.653 . . . . 73.24 109.341 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 442' ' ' ASN . . . . . 0.473 ' HB2' ' HB3' ' A' ' 525' ' ' ALA . 7.9 p30 -124.99 160.3 29.29 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.17 -0.678 . . . . 72.22 109.17 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 12.9 t -117.45 165.47 12.77 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 N-CA-C 107.692 -1.225 . . . . 75.13 107.692 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.588 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 63.7 mtm180 -85.12 66.96 10.01 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.822 0.82 . . . . 71.32 110.735 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -106.41 7.64 31.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.031 -0.986 . . . . 71.13 111.179 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.477 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 18.4 m -106.24 137.08 44.83 Favored 'General case' 0 N--CA 1.416 -2.142 0 C-N-CA 119.445 -0.902 . . . . 74.34 108.874 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -115.54 132.57 64.53 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.265 0 N-CA-C 107.557 -1.275 . . . . 55.22 107.557 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.29 125.56 50.65 Favored 'General case' 0 C--N 1.274 -2.716 0 N-CA-C 108.213 -1.032 . . . . 74.54 108.213 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 17.7 mt -105.33 143.65 33.21 Favored 'General case' 0 C--N 1.275 -2.646 0 N-CA-C 105.913 -1.884 . . . . 75.51 105.913 178.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' ARG . . . . . 0.417 ' HD3' ' OE1' ' A' ' 519' ' ' GLU . 49.2 ttt180 -152.62 141.28 20.9 Favored 'General case' 0 C--N 1.289 -2.023 0 C-N-CA 120.907 -0.317 . . . . 74.12 110.16 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 85.05 23.6 48.24 Favored Glycine 0 C--N 1.311 -0.827 0 N-CA-C 110.615 -0.994 . . . . 71.14 110.615 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.08 151.07 67.8 Favored Pre-proline 0 C--O 1.244 0.776 0 C-N-CA 123.974 0.91 . . . . 71.21 112.998 -176.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -61.45 151.91 76.53 Favored 'Trans proline' 0 N--CA 1.442 -1.509 0 C-N-CA 122.853 2.369 . . . . 72.22 110.642 173.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -77.68 92.23 4.11 Favored 'General case' 0 C--N 1.275 -2.634 0 CA-C-N 114.817 -1.083 . . . . 73.4 110.035 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.22 36.07 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.022 0 CA-C-N 112.226 -2.261 . . . . 43.41 112.456 174.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.66 124.49 19.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 107.717 -1.216 . . . . 65.44 107.717 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 8.6 p -76.13 150.27 37.24 Favored 'General case' 0 N--CA 1.399 -3.012 0 N-CA-C 109.123 -0.695 . . . . 65.43 109.123 -175.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.276 2.4 pp -61.7 -30.73 48.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 114.277 1.214 . . . . 70.43 114.277 -173.133 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 459' ' ' GLU . . . . . 0.432 ' N ' HD12 ' A' ' 458' ' ' ILE . 0.0 OUTLIER -81.56 -22.27 37.91 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.542 -0.863 . . . . 72.41 110.04 -177.7 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 460' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 20.6 t70 -75.67 -40.23 56.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.162 -0.926 . . . . 75.0 109.177 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 13.7 tt -76.0 -32.28 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 115.214 -0.903 . . . . 71.21 110.263 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 84.4 mt -72.14 -29.42 64.03 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.348 -0.612 . . . . 75.13 109.348 176.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 463' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 25.8 t70 -63.16 -53.39 54.1 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-N 115.324 -0.853 . . . . 61.43 108.784 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.81 -42.04 64.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 114.539 -1.21 . . . . 73.23 111.435 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.94 -37.16 78.7 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.828 -0.624 . . . . 53.32 110.982 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 77.36 -140.56 24.68 Favored Glycine 0 N--CA 1.421 -2.32 0 C-N-CA 120.42 -0.895 . . . . 71.12 112.153 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -48.63 -32.08 7.69 Favored 'General case' 0 C--N 1.291 -1.971 0 C-N-CA 126.238 1.815 . . . . 61.43 113.137 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -66.61 -23.44 66.18 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.965 0.412 . . . . 74.42 111.393 -177.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.93 -15.48 60.69 Favored 'General case' 0 C--O 1.206 -1.201 0 CA-C-N 116.136 -0.484 . . . . 63.44 111.532 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.8 m -78.08 -16.83 57.67 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-O 121.389 0.614 . . . . 75.32 110.387 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' ASP . . . . . 0.419 ' OD1' ' HB3' ' A' ' 495' ' ' MET . 11.7 t70 -84.69 -11.9 54.94 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 116.274 -0.421 . . . . 73.43 111.431 -175.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 472' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.1 tt -52.39 145.78 2.53 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 124.194 0.998 . . . . 71.12 111.889 -176.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 473' ' ' ARG . . . . . 0.423 ' O ' HG12 ' A' ' 472' ' ' ILE . 84.8 mtt180 -75.46 158.06 33.16 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.066 -1.087 . . . . 73.25 108.066 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 7.7 t -57.82 110.45 0.91 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-O 121.416 0.627 . . . . 72.21 111.065 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 62.29 27.01 16.18 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.57 1.148 . . . . 75.4 111.088 -176.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.63 19.11 2.06 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 115.276 0.87 . . . . 54.3 115.276 -176.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.5 p -93.61 110.6 23.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-O 121.536 0.684 . . . . 72.41 109.714 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -108.85 94.91 5.3 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.571 -1.27 . . . . 71.15 107.571 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' MET . . . . . 0.544 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 53.6 ttm -87.67 139.31 30.66 Favored 'General case' 0 C--N 1.287 -2.133 0 C-N-CA 120.394 -0.522 . . . . 53.41 109.73 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 66.3 t -81.67 97.85 3.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 N-CA-C 108.826 -0.805 . . . . 74.14 108.826 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.4 mt -97.26 154.02 17.67 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.369 -1.287 . . . . 73.51 107.83 178.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -93.32 173.44 7.71 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.391 -1.707 . . . . 74.34 106.391 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -59.35 -27.51 66.0 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 119.279 0.945 . . . . 74.11 111.724 -176.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -70.37 -11.84 61.18 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.746 0.819 . . . . 75.22 111.155 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 82.5 29.03 37.39 Favored Glycine 0 N--CA 1.432 -1.6 0 CA-C-N 116.131 -0.486 . . . . 32.43 112.412 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -123.1 140.24 33.18 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 108.437 -0.949 . . . . 71.45 108.437 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' PRO . . . . . 0.544 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 29.7 Cg_endo -63.51 134.23 43.63 Favored 'Trans proline' 0 C--O 1.242 0.707 0 C-N-CA 122.906 2.404 . . . . 64.03 113.727 -177.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 17.7 m -76.31 -18.58 58.88 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.735 0.779 . . . . 64.24 109.796 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 106.7 15.85 15.75 Favored Glycine 0 CA--C 1.497 -1.084 0 N-CA-C 111.172 -0.771 . . . . 71.53 111.172 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -127.42 151.85 48.28 Favored 'General case' 0 C--O 1.256 1.433 0 N-CA-C 105.412 -2.07 . . . . 61.35 105.412 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -165.21 153.95 12.09 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 118.153 0.433 . . . . 51.52 110.062 -177.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -125.69 120.13 29.85 Favored 'General case' 0 C--N 1.288 -2.101 0 N-CA-C 108.669 -0.863 . . . . 75.11 108.669 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 56.7 mt -107.66 130.18 60.42 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.53 0 N-CA-C 107.059 -1.459 . . . . 61.45 107.059 176.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.477 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 9.3 tt0 -104.5 116.98 33.04 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.155 0.503 . . . . 75.41 110.155 -177.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.419 ' HB3' ' OD1' ' A' ' 471' ' ' ASP . 0.3 OUTLIER -92.79 172.59 8.25 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.197 -0.91 . . . . 72.22 110.192 178.09 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.407 ' HG2' ' HG2' ' A' ' 473' ' ' ARG . 36.0 mtmm -88.16 -35.28 17.49 Favored 'General case' 0 N--CA 1.394 -3.253 0 CA-C-N 116.21 -0.45 . . . . 72.21 110.472 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.4 m -116.25 141.12 48.56 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-O 121.526 0.679 . . . . 44.1 112.085 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -73.03 -16.12 61.5 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.202 -0.908 . . . . 70.44 110.969 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -62.03 -56.38 19.57 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.654 -0.703 . . . . 75.21 109.686 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.27 70.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.082 -0.963 . . . . 71.01 111.243 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.17 -42.76 83.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.11 -0.496 . . . . 72.22 110.71 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -66.69 -44.48 81.62 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.072 0.463 . . . . 73.41 110.287 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 38.5 tpp -71.14 -33.32 69.96 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.75 -0.659 . . . . 74.5 110.991 -175.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.36 -40.55 81.43 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 109.647 -0.501 . . . . 71.11 109.647 176.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -69.41 -30.19 68.09 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.962 -0.563 . . . . 62.02 111.537 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -76.34 -40.78 50.4 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 120.811 -0.356 . . . . 74.24 110.509 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -69.88 -43.3 72.1 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.278 0.561 . . . . 55.41 110.63 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 61.0 m -99.35 16.75 22.03 Favored 'General case' 0 N--CA 1.415 -2.201 0 N-CA-C 113.529 0.937 . . . . 44.05 113.529 -173.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' HIS . . . . . 0.425 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 10.9 t-80 -66.68 91.76 0.2 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.303 -0.559 . . . . 75.01 110.158 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 99.4 mttt 67.93 35.74 3.69 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 125.037 1.335 . . . . 52.14 110.758 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -80.35 147.77 30.93 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.614 -1.175 . . . . 74.13 109.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.49 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 13.8 m120 -74.72 120.3 20.08 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 115.724 -0.671 . . . . 74.25 110.311 178.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.1 ttt -102.15 93.16 5.08 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 106.088 -1.819 . . . . 74.14 106.088 175.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 67.71 -77.38 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 124.297 1.039 . . . . 73.14 111.185 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -125.38 -18.49 5.31 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-O 121.811 0.815 . . . . 74.42 110.713 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 22.7 tpt180 -90.79 160.86 15.56 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.253 -0.885 . . . . 75.42 109.956 -170.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -113.91 116.26 28.99 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.29 -1.744 . . . . 74.54 106.29 172.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 92.9 t -110.86 122.0 64.57 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.921 0 CA-C-N 116.33 -0.396 . . . . 63.42 109.946 -176.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' GLU . . . . . 0.417 ' OE1' ' HD3' ' A' ' 450' ' ' ARG . 41.7 tt0 -85.71 109.46 18.63 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 107.891 -1.151 . . . . 75.23 107.891 176.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 520' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' A' ' 505' ' ' ALA . 97.5 t -105.02 124.65 59.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.295 -1.372 . . . . 52.11 107.295 176.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -133.4 138.28 46.2 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.44 -0.948 . . . . 51.11 108.44 -173.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' GLN . . . . . 0.415 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 46.4 tt0 -83.16 153.25 24.88 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.626 -0.509 . . . . 73.41 109.626 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 523' ' ' CYS . . . . . 0.415 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 5.9 p -162.66 171.5 16.79 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 122.769 0.428 . . . . 74.42 110.004 -177.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.588 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 1.3 m -97.59 160.47 14.3 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.7 -0.682 . . . . 73.35 109.429 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 525' ' ' ALA . . . . . 0.473 ' HB3' ' HB2' ' A' ' 442' ' ' ASN . . . -59.88 -21.71 61.38 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.629 -0.714 . . . . 71.42 111.535 177.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.39 -54.1 23.46 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 116.343 -0.39 . . . . 72.03 110.372 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -38.51 82.7 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 110.215 -0.291 . . . . 75.31 110.215 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -59.35 -44.77 92.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.857 -0.61 . . . . 72.41 110.445 177.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -69.32 -40.67 77.49 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.315 0.579 . . . . 71.53 109.567 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -59.62 -44.53 93.42 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.221 -0.899 . . . . 54.31 111.271 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.4 t -73.65 -34.6 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 120.38 -0.528 . . . . 61.04 110.377 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.99 -21.91 62.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 74.33 111.443 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 65.5 mtm -88.49 -0.49 57.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.187 0.518 . . . . 73.33 111.153 176.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 74.69 27.25 65.45 Favored Glycine 0 C--N 1.301 -1.391 0 CA-C-N 115.242 -0.89 . . . . 64.24 112.77 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -69.11 140.28 33.91 Favored Glycine 0 N--CA 1.416 -2.683 0 N-CA-C 111.685 -0.566 . . . . 72.41 111.685 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 28.5 m -151.89 129.61 11.59 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.387 -0.968 . . . . 61.13 108.387 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 91.1 mt -80.12 97.28 6.79 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.275 -1.009 . . . . 74.32 108.275 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -90.19 65.04 6.28 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-O 122.674 1.226 . . . . 71.12 112.682 -176.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -140.26 94.47 2.75 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 106.763 -1.569 . . . . 71.21 106.763 174.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -155.13 137.64 15.06 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.246 -0.888 . . . . 60.21 110.444 -175.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 . . . . . 0 C--N 1.299 -1.621 0 N-CA-C 107.993 -1.114 . . . . 73.31 107.993 179.391 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 438' ' ' MET . . . . . 0.439 ' SD ' HG21 ' A' ' 443' ' ' VAL . 19.9 ptp . . . . . 0 CA--C 1.515 -0.385 0 N-CA-C 108.717 -0.846 . . . . 54.21 108.717 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -82.31 167.93 15.24 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 121.83 1.686 . . . . 75.24 108.714 171.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.34 105.52 0.15 Allowed 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.685 2.257 . . . . 65.1 111.413 178.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.4 m -142.3 159.37 42.37 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 107.771 -1.196 . . . . 64.35 107.771 -175.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 442' ' ' ASN . . . . . 0.412 ' OD1' ' HB2' ' A' ' 524' ' ' SER . 49.3 t30 -82.71 111.94 19.11 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.467 -0.938 . . . . 72.52 108.467 175.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 443' ' ' VAL . . . . . 0.439 HG21 ' SD ' ' A' ' 438' ' ' MET . 47.5 t -108.85 144.54 17.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 N-CA-C 109.672 -0.492 . . . . 72.22 109.672 -176.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.538 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 19.8 ptt85 -92.35 65.72 4.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.168 0.985 . . . . 74.22 111.401 177.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 33.2 p30 -112.75 12.11 19.55 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.294 -0.866 . . . . 74.41 110.408 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 30.7 m -109.18 145.77 35.25 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 108.752 -0.833 . . . . 62.13 108.752 -177.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.72 140.07 49.99 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.111 0 N-CA-C 108.248 -1.019 . . . . 55.25 108.248 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -111.6 121.69 45.83 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.07 -1.085 . . . . 70.41 108.07 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.9 mt -103.41 132.18 49.88 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 106.488 -1.671 . . . . 75.43 106.488 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -126.86 136.61 52.58 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 118.419 0.554 . . . . 55.35 109.621 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 516' ' ' ARG . . . 96.09 38.86 4.46 Favored Glycine 0 C--N 1.31 -0.885 0 C-N-CA 120.489 -0.862 . . . . 41.22 111.654 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.1 mt -83.54 144.33 45.78 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.991 -0.374 . . . . 70.44 109.991 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.472 ' HB2' ' HB2' ' A' ' 456' ' ' ALA . 31.8 Cg_exo -50.15 143.96 24.0 Favored 'Trans proline' 0 C--O 1.253 1.266 0 C-N-CA 123.113 2.542 . . . . 62.53 111.065 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -70.88 92.6 0.92 Allowed 'General case' 0 N--CA 1.417 -2.081 0 CA-C-O 122.402 1.096 . . . . 74.14 111.469 -177.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.87 33.62 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 111.162 -2.744 . . . . 33.13 112.415 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 456' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 453' ' ' PRO . . . -56.01 138.42 49.16 Favored 'General case' 0 C--O 1.246 0.883 0 N-CA-C 109.44 -0.578 . . . . 40.44 109.44 171.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 28.4 p -78.06 160.22 28.23 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 116.42 -0.354 . . . . 63.42 111.02 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.472 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 65.4 mt -65.34 -31.93 56.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.262 0.554 . . . . 63.1 109.601 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -64.01 -40.2 95.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.052 0.453 . . . . 54.31 110.249 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -70.16 -37.83 75.29 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.428 -0.806 . . . . 73.11 110.161 -176.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.421 HG22 ' HA ' ' A' ' 458' ' ' ILE . 13.4 tt -74.59 -32.01 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.027 -0.533 . . . . 75.11 110.651 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -67.31 -35.38 79.32 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.451 0.643 . . . . 53.43 110.001 176.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -65.13 -49.02 71.51 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.621 -0.881 . . . . 64.35 108.621 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -53.73 -41.92 67.58 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 113.894 -1.503 . . . . 75.13 111.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.88 -36.68 84.72 Favored 'General case' 0 C--O 1.248 0.998 0 CA-C-N 116.129 -0.487 . . . . 74.43 111.718 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 84.11 -143.18 21.06 Favored Glycine 0 N--CA 1.422 -2.29 0 C-N-CA 120.099 -1.048 . . . . 61.21 111.706 -178.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -54.52 -34.27 61.43 Favored 'General case' 0 C--N 1.3 -1.561 0 C-N-CA 123.527 0.731 . . . . 65.22 111.066 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' PHE . . . . . 0.411 ' O ' ' HE1' ' A' ' 495' ' ' MET . 95.0 m-85 -61.3 -17.45 53.71 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.559 -0.746 . . . . 73.14 112.599 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 469' ' ' ALA . . . . . 0.473 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -68.25 -15.29 63.52 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 120.836 0.35 . . . . 52.34 111.397 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 17.3 m -84.77 -20.53 30.88 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-O 121.894 0.854 . . . . 52.45 109.194 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -107.43 15.52 24.8 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.362 -0.835 . . . . 70.04 112.365 -174.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 472' ' ' ILE . . . . . 0.473 HG22 ' O ' ' A' ' 469' ' ' ALA . 11.6 tt -82.55 151.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 106.316 -1.735 . . . . 65.0 106.316 170.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 20.8 mtm-85 -100.3 153.76 19.04 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 118.975 -1.09 . . . . 61.14 111.128 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 10.0 t -62.58 136.27 57.81 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.566 -0.901 . . . . 71.23 108.566 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 67.9 22.83 8.54 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 122.294 1.045 . . . . 72.22 109.376 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -88.08 -20.46 49.54 Favored Glycine 0 N--CA 1.423 -2.224 0 C-N-CA 120.701 -0.762 . . . . 62.52 112.853 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 47.8 t -89.66 115.19 28.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 117.011 0.406 . . . . 63.21 110.988 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -127.65 98.09 5.08 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.881 -0.785 . . . . 75.22 108.881 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 86.0 mtp -83.9 139.44 32.61 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.849 -0.426 . . . . 62.21 109.849 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 43.0 t -84.04 97.98 5.33 Favored 'Isoleucine or valine' 0 C--O 1.251 1.171 0 CA-C-O 121.553 0.692 . . . . 71.14 109.728 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 65.2 mt -86.14 155.95 20.55 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.885 -1.154 . . . . 71.52 107.885 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -96.26 -178.67 4.39 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.583 -1.636 . . . . 72.33 106.583 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 47.5 m-70 -65.62 -9.81 30.21 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 119.022 0.828 . . . . 74.34 112.235 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' GLN . . . . . 0.436 ' OE1' ' HD3' ' A' ' 486' ' ' ARG . 35.2 tt0 -81.38 -12.79 58.86 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 123.855 0.862 . . . . 53.44 108.877 176.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 75.33 29.19 60.49 Favored Glycine 0 CA--C 1.494 -1.242 0 CA-C-N 115.275 -0.875 . . . . 62.33 111.373 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.436 ' HD3' ' OE1' ' A' ' 484' ' ' GLN . 62.1 mtp85 -133.16 147.96 67.29 Favored Pre-proline 0 C--N 1.308 -1.238 0 N-CA-C 107.945 -1.132 . . . . 63.23 107.945 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -54.93 134.47 63.57 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 123.734 2.956 . . . . 53.14 115.061 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.7 m -75.48 -33.98 60.86 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.176 -0.92 . . . . 31.43 108.884 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 137.16 -16.35 3.66 Favored Glycine 0 CA--C 1.493 -1.309 0 N-CA-C 110.806 -0.917 . . . . 54.21 110.806 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -116.4 158.7 23.09 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-O 121.021 0.439 . . . . 63.25 110.554 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.33 167.69 29.54 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.687 -0.688 . . . . 55.03 109.53 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -120.08 145.2 47.1 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.064 -0.717 . . . . 72.34 109.064 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 46.5 mt -133.44 131.89 57.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 N-CA-C 107.665 -1.235 . . . . 74.24 107.665 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -106.47 124.47 49.65 Favored 'General case' 0 C--N 1.284 -2.269 0 CA-C-O 121.477 0.655 . . . . 74.45 109.997 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.411 ' HE1' ' O ' ' A' ' 468' ' ' PHE . 96.3 mmm -98.08 170.05 9.18 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.79 -1.095 . . . . 72.11 110.994 -175.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -65.3 -46.39 80.58 Favored 'General case' 0 C--N 1.28 -2.432 0 C-N-CA 125.894 1.678 . . . . 55.22 111.738 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.7 m -130.22 142.61 50.55 Favored 'General case' 0 N--CA 1.408 -2.545 0 N-CA-C 108.617 -0.883 . . . . 55.14 108.617 -172.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.83 74.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.97 0.89 . . . . 75.12 111.126 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.84 -46.1 66.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 114.294 -1.321 . . . . 74.24 110.17 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -62.28 -38.26 88.66 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.821 -1.081 . . . . 72.21 110.293 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.34 -37.93 88.59 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.393 -0.821 . . . . 41.23 111.204 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.71 -41.46 83.51 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 110.045 -0.354 . . . . 61.22 110.045 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 54.8 ttm -67.81 -38.93 83.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.301 -0.408 . . . . 62.2 110.224 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.23 86.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.97 -0.559 . . . . 64.43 110.354 177.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.03 84.32 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.979 -0.555 . . . . 54.34 110.894 177.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -64.83 -42.09 95.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.702 -0.481 . . . . 74.12 109.702 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.05 -45.29 94.2 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.411 0.624 . . . . 65.51 111.105 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.7 m -94.45 6.75 47.81 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 112.848 0.684 . . . . 61.12 112.848 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -76.05 108.35 8.9 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.342 -0.849 . . . . 71.11 108.792 175.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.433 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 44.0 mttp 72.8 17.32 4.39 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.233 1.013 . . . . 64.35 112.066 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.17 138.27 36.84 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 115.894 -0.593 . . . . 73.34 109.801 -178.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -76.11 136.08 39.85 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 115.038 -0.983 . . . . 63.34 111.994 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.4 ttt -129.8 103.25 6.7 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 105.519 -2.03 . . . . 73.25 105.519 175.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 71.3 -78.89 0.04 OUTLIER 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.708 1.203 . . . . 63.21 110.698 -175.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -138.63 -14.79 1.23 Allowed 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.579 0.704 . . . . 64.01 111.843 176.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 451' ' ' GLY . 0.4 OUTLIER -92.23 156.46 17.28 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.891 -1.151 . . . . 64.53 107.891 -175.22 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -109.66 118.84 37.62 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-O 121.492 0.663 . . . . 73.02 109.321 173.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.9 t -92.35 131.23 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.262 0 N-CA-C 107.855 -1.165 . . . . 73.32 107.855 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 519' ' ' GLU . . . . . 0.433 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 42.7 mt-10 -104.94 113.6 27.3 Favored 'General case' 0 N--CA 1.413 -2.31 0 N-CA-C 108.997 -0.742 . . . . 72.22 108.997 175.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 76.0 t -104.08 129.77 55.78 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.606 -1.179 . . . . 71.41 111.196 -177.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -127.57 141.94 51.5 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.281 -0.872 . . . . 73.43 109.076 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -84.0 151.92 24.73 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 117.958 0.345 . . . . 73.22 111.509 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.4 p -155.31 173.23 16.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 123.621 0.768 . . . . 62.53 109.746 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.5 p -102.13 159.59 15.25 Favored 'General case' 0 C--N 1.284 -2.266 0 N-CA-C 112.705 0.631 . . . . 71.41 112.705 -179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.34 -37.62 67.69 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 123.871 0.869 . . . . 41.33 112.086 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.94 -35.64 81.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.997 -0.547 . . . . 75.15 110.713 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.73 -39.77 84.25 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 123.345 0.403 . . . . 61.11 110.568 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 528' ' ' MET . . . . . 0.544 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 42.6 ttm -59.58 -48.45 81.6 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.181 -0.674 . . . . 55.4 109.181 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.38 -35.49 80.56 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.069 -0.969 . . . . 74.44 110.203 -179.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -65.76 -42.3 91.02 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.657 -0.701 . . . . 54.41 110.153 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 88.1 t -72.58 -34.14 46.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 120.932 0.396 . . . . 71.24 110.5 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.9 mt -67.5 -35.51 79.29 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.187 0.518 . . . . 50.14 110.061 176.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 26.3 ttt -73.16 -18.44 61.27 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 122.104 0.954 . . . . 74.33 111.023 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 83.34 22.75 56.15 Favored Glycine 0 C--N 1.273 -2.968 0 CA-C-N 114.16 -1.382 . . . . 62.02 111.963 -177.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -64.69 136.07 38.6 Favored Glycine 0 N--CA 1.413 -2.874 0 N-CA-C 110.654 -0.978 . . . . 43.14 110.654 178.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 8.6 m -77.54 118.05 19.58 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-O 121.352 0.596 . . . . 63.21 110.361 -176.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 63.1 tp -111.59 94.36 4.92 Favored 'General case' 0 C--N 1.282 -2.359 0 N-CA-C 106.7 -1.593 . . . . 72.31 106.7 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -131.11 174.24 10.22 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 109.032 -0.729 . . . . 50.52 109.032 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 64.83 57.87 1.0 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 125.188 1.395 . . . . 72.34 109.611 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 91.0 mt -119.17 112.73 19.87 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.144 -0.935 . . . . 74.22 109.29 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 . . . . . 0 C--N 1.3 -1.583 0 N-CA-C 109.466 -0.568 . . . . 75.44 109.466 -178.704 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.496 -1.101 0 N-CA-C 108.58 -0.896 . . . . 65.5 108.58 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -70.54 150.36 63.35 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 121.529 1.486 . . . . 72.14 110.192 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.85 -17.13 29.24 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 121.791 1.66 . . . . 75.12 110.632 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 27.4 m -115.7 105.37 12.66 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 114.945 -1.025 . . . . 52.44 108.843 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -110.27 141.2 43.57 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 109.27 -0.641 . . . . 72.21 109.27 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -98.54 163.58 2.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 N-CA-C 108.536 -0.913 . . . . 62.41 108.536 -175.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.597 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 26.7 mtp180 -90.82 73.8 6.57 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-O 121.846 0.832 . . . . 75.43 109.72 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 26.4 p-10 -114.68 14.06 17.48 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 115.011 -0.995 . . . . 71.25 109.87 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 25.4 m -116.3 149.66 38.91 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 107.628 -1.249 . . . . 75.33 107.628 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -124.34 139.33 50.98 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.449 0 N-CA-C 108.935 -0.765 . . . . 63.53 108.935 -177.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -109.97 123.49 49.75 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.083 -1.081 . . . . 64.21 108.083 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 18.2 mt -99.83 144.36 28.98 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 106.979 -1.489 . . . . 73.24 106.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -141.28 140.0 33.79 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.545 -0.909 . . . . 72.34 108.545 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 84.06 32.03 24.46 Favored Glycine 0 C--N 1.291 -1.948 0 C-N-CA 120.315 -0.945 . . . . 74.53 111.727 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.1 138.35 89.75 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 115.981 -0.109 . . . . 74.01 110.852 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -58.25 144.97 94.95 Favored 'Trans proline' 0 CA--C 1.486 -1.914 0 C-N-CA 122.549 2.166 . . . . 73.52 111.31 176.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -78.14 106.69 10.19 Favored 'General case' 1 N--CA 1.376 -4.144 0 N-CA-C 106.908 -1.516 . . . . 73.32 106.908 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.97 29.61 0.02 OUTLIER 'General case' 0 C--N 1.267 -2.986 0 CA-C-N 111.91 -2.404 . . . . 62.15 112.841 173.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -87.3 120.03 28.17 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.317 -1.364 . . . . 64.11 107.317 169.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 457' ' ' THR . . . . . 0.581 ' HB ' ' OE1' ' A' ' 459' ' ' GLU . 20.1 p -74.39 157.24 36.02 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.389 0.138 . . . . 64.53 110.917 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.564 ' HA ' HG22 ' A' ' 461' ' ' ILE . 2.7 pp -65.34 -25.0 36.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 CA-C-O 121.19 0.519 . . . . 73.12 112.093 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' GLU . . . . . 0.581 ' OE1' ' HB ' ' A' ' 457' ' ' THR . 6.3 mp0 -68.21 -33.75 74.98 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.01 -0.737 . . . . 54.44 109.01 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -77.18 -34.1 56.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.21 -0.905 . . . . 50.14 109.646 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.564 HG22 ' HA ' ' A' ' 458' ' ' ILE . 13.4 tt -78.74 -32.2 15.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.983 0 C-N-CA 120.092 -0.643 . . . . 73.34 111.062 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.82 -30.82 71.1 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.939 -0.476 . . . . 72.22 110.866 175.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -63.79 -53.28 53.35 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.944 -1.132 . . . . 61.23 107.944 172.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 461' ' ' ILE . 80.1 t80 -51.92 -41.97 62.41 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 113.297 -1.774 . . . . 72.1 111.727 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 465' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 91.3 mt -64.65 -37.3 87.12 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.725 -0.67 . . . . 75.12 111.565 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 90.4 -141.85 16.08 Favored Glycine 0 N--CA 1.419 -2.496 0 C-N-CA 120.255 -0.974 . . . . 41.51 112.253 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.56 -27.88 12.26 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 124.852 1.261 . . . . 62.32 112.186 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -64.63 -13.53 54.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.591 . . . . 71.44 112.418 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -67.36 -19.92 65.49 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.105 0.478 . . . . 72.02 111.176 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.2 m -101.71 0.46 36.04 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-O 121.968 0.89 . . . . 63.02 109.811 176.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' ASP . . . . . 0.424 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 58.6 m-20 -108.56 6.14 25.72 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 121.816 -0.552 . . . . 63.1 112.333 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 472' ' ' ILE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 495' ' ' MET . 7.6 tt -88.74 151.71 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.791 0 N-CA-C 107.61 -1.256 . . . . 43.31 107.61 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 42.5 ptt85 -78.02 161.88 27.15 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 118.48 -1.288 . . . . 63.3 109.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 32.7 m -66.69 115.87 6.99 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 115.589 -0.732 . . . . 74.31 110.483 -175.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 65.44 28.81 11.55 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.616 1.166 . . . . 74.32 109.741 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -80.0 8.22 52.01 Favored Glycine 0 N--CA 1.442 -0.902 0 CA-C-N 115.448 -0.796 . . . . 62.33 114.392 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.96 118.85 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.812 -0.811 . . . . 41.35 108.812 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -117.18 135.35 53.84 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 107.34 -1.356 . . . . 65.2 107.34 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 52.7 tpp -116.05 138.52 51.15 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 108.861 -0.792 . . . . 62.22 108.861 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.05 106.01 16.03 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.128 0 N-CA-C 108.327 -0.99 . . . . 43.45 108.327 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 60.1 mt -89.8 147.39 23.83 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 106.344 -1.725 . . . . 73.33 106.344 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -90.33 -169.38 2.39 Favored 'General case' 0 C--N 1.27 -2.882 0 CA-C-N 115.919 -0.582 . . . . 51.3 109.915 -176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -62.64 -29.06 70.34 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.526 0.679 . . . . 60.13 110.362 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -79.99 -7.0 58.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.542 -0.753 . . . . 74.31 110.55 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 485' ' ' GLY . . . . . 0.456 ' C ' ' HD2' ' A' ' 486' ' ' ARG . . . 79.36 21.88 66.22 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 116.263 -0.426 . . . . 71.03 113.075 176.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.456 ' HD2' ' C ' ' A' ' 485' ' ' GLY . 8.5 mpt_? -120.31 151.32 53.29 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 108.667 -0.864 . . . . 71.45 108.667 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.15 123.38 13.7 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.467 2.112 . . . . 72.31 112.574 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 13.0 m -74.92 -8.35 56.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.689 -0.687 . . . . 71.33 111.004 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 87.74 16.43 59.92 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.368 -1.093 . . . . 42.41 110.368 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -125.56 132.78 52.5 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 103.968 -2.605 . . . . 54.22 103.968 -178.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -148.56 167.08 26.34 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 118.381 0.537 . . . . 53.5 110.42 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 85.4 m-85 -135.48 120.59 18.82 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 123.231 0.612 . . . . 74.33 109.606 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.4 mt -110.54 131.96 60.23 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 108.054 -1.091 . . . . 71.14 108.054 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -103.91 124.78 49.59 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 108.568 -0.901 . . . . 71.13 108.568 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.417 ' HA ' ' HA ' ' A' ' 472' ' ' ILE . 91.1 mmm -98.7 175.05 6.12 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.272 0.558 . . . . 73.25 111.304 -174.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -71.8 -34.77 69.66 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 124.933 1.293 . . . . 60.42 110.55 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 30.6 t -152.18 153.59 34.14 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 115.007 -0.997 . . . . 75.25 109.962 -172.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.2 75.36 Favored 'General case' 0 CA--C 1.508 -0.673 0 C-N-CA 123.814 0.846 . . . . 71.43 110.815 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -59.09 -48.23 82.37 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 122.488 1.137 . . . . 61.43 109.959 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' ARG . . . . . 0.424 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 1.5 mmp_? -65.7 -40.98 92.86 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 113.227 -1.806 . . . . 74.34 109.832 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.97 -40.99 87.59 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.281 -0.872 . . . . 73.32 110.581 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -66.12 -38.35 87.97 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.647 -0.706 . . . . 74.02 110.93 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 83.8 mtp -75.63 -36.31 60.24 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 119.482 -0.887 . . . . 64.02 110.965 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.22 -41.1 90.56 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.283 -0.417 . . . . 75.22 110.596 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.76 -36.18 80.06 Favored 'General case' 0 C--O 1.203 -1.371 0 CA-C-N 116.067 -0.515 . . . . 55.24 110.38 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -44.72 82.06 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.477 -0.329 . . . . 75.14 110.898 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -63.45 -43.55 97.07 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.668 0.605 . . . . 73.21 111.369 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.8 m -101.67 10.99 39.6 Favored 'General case' 0 N--CA 1.432 -1.354 0 N-CA-C 112.726 0.639 . . . . 54.05 112.726 -173.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' HIS . . . . . 0.47 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 44.0 t60 -70.4 97.56 1.29 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 119.853 -0.739 . . . . 75.33 109.206 176.044 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 66.4 66.24 0.47 Allowed 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 125.156 1.383 . . . . 74.12 110.203 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.3 tptt -112.79 140.81 47.26 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.323 -1.762 . . . . 72.43 108.818 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -86.32 132.46 33.97 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 120.211 -0.596 . . . . 72.41 110.596 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.3 ttt -118.26 88.66 2.96 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 106.13 -1.804 . . . . 72.21 106.13 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt 68.99 -83.52 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.059 -1.428 . . . . 74.01 113.01 -176.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -121.87 -9.77 8.76 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.393 0.616 . . . . 70.13 110.833 -173.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -115.24 156.65 24.99 Favored 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 108.518 -0.919 . . . . 71.45 108.518 -173.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -108.85 121.45 45.11 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 121.112 0.482 . . . . 73.13 109.787 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' VAL . . . . . 0.425 HG12 HG23 ' A' ' 520' ' ' VAL . 60.5 t -102.9 114.04 41.34 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.951 0 CA-C-N 114.53 -1.214 . . . . 74.43 108.153 -178.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -104.51 110.37 22.62 Favored 'General case' 0 C--N 1.279 -2.497 0 N-CA-C 107.625 -1.25 . . . . 65.42 107.625 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 520' ' ' VAL . . . . . 0.425 HG23 HG12 ' A' ' 518' ' ' VAL . 73.5 t -104.82 129.02 58.04 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 CA-C-N 115.709 -0.678 . . . . 63.42 111.336 -175.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -116.06 152.11 34.23 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.325 -0.991 . . . . 75.32 108.325 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -90.99 157.81 17.07 Favored 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 106.835 -1.542 . . . . 74.01 106.835 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -157.69 160.51 38.03 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.405 0.622 . . . . 71.42 112.422 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.597 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 38.1 t -86.09 150.83 24.16 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.727 -1.124 . . . . 71.4 109.037 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.01 -30.03 67.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.208 0.528 . . . . 72.44 110.189 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -65.85 -51.47 58.6 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.56 1.144 . . . . 75.13 109.572 176.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -64.81 -37.48 87.76 Favored 'General case' 0 C--N 1.297 -1.69 0 C-N-CA 126.067 1.747 . . . . 72.25 109.798 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 528' ' ' MET . . . . . 0.441 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.2 ttt -67.03 -44.63 79.76 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.315 -0.857 . . . . 70.41 109.566 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -65.57 -38.11 88.6 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.874 -0.603 . . . . 61.43 109.779 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -59.31 -45.88 90.1 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.43 -0.805 . . . . 74.3 110.742 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 60.4 t -68.89 -39.65 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 120.18 -0.608 . . . . 74.51 110.326 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.5 mt -64.91 -28.67 69.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.489 . . . . 71.14 112.22 -178.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 24.3 mmt -83.86 15.78 3.14 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.049 0.388 . . . . 72.34 112.049 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 90.28 45.31 4.43 Favored Glycine 0 N--CA 1.428 -1.886 0 N-CA-C 110.935 -0.866 . . . . 32.4 110.935 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -66.51 130.67 31.75 Favored Glycine 0 N--CA 1.409 -3.108 0 CA-C-N 115.091 -0.554 . . . . 73.23 112.806 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 9.5 t -67.65 140.94 56.85 Favored 'General case' 0 N--CA 1.426 -1.647 0 N-CA-C 108.422 -0.955 . . . . 74.42 108.422 177.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 34.0 tp -116.66 76.4 1.03 Allowed 'General case' 0 C--N 1.292 -1.922 0 CA-C-O 121.986 0.898 . . . . 72.43 109.536 -178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 42.5 t-20 -100.6 102.67 13.87 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 105.749 -1.945 . . . . 70.53 105.749 178.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' ARG . . . . . 0.44 ' HD3' ' OE1' ' A' ' 541' ' ' GLU . 19.0 ptp180 -68.1 154.42 41.7 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 115.731 -0.668 . . . . 71.24 110.506 -176.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.1 tt -151.66 100.07 2.66 Favored 'General case' 0 N--CA 1.409 -2.502 0 N-CA-C 104.026 -2.583 . . . . 62.35 104.026 173.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 541' ' ' GLU . . . . . 0.44 ' OE1' ' HD3' ' A' ' 539' ' ' ARG . 13.7 pt-20 . . . . . 0 C--N 1.289 -2.025 0 CA-C-N 115.582 -0.735 . . . . 74.32 109.706 -177.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 CA--C 1.51 -0.593 0 N-CA-C 110.179 -0.304 . . . . 72.02 110.179 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.93 156.56 48.41 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.047 1.831 . . . . 75.33 110.124 173.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -53.82 160.51 5.65 Favored 'Trans proline' 0 C--O 1.255 1.35 0 C-N-CA 123.66 2.907 . . . . 72.53 113.506 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 18.7 m 67.55 77.07 0.27 Allowed 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.788 -1.096 . . . . 44.41 109.03 -175.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -82.97 119.46 24.47 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 114.718 -1.128 . . . . 72.15 109.553 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 36.6 t -92.8 161.01 2.62 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.741 0 N-CA-C 107.712 -1.218 . . . . 63.45 107.712 -178.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.57 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.6 mtm180 -88.1 75.76 8.63 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 108.507 -0.923 . . . . 72.44 108.507 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -116.18 11.17 15.12 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.173 -1.376 . . . . 75.4 112.196 -171.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 56.6 m -106.63 152.43 23.76 Favored 'General case' 0 N--CA 1.407 -2.575 0 C-N-CA 119.547 -0.861 . . . . 65.43 109.464 -176.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 447' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -122.26 140.13 47.09 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.109 0 N-CA-C 106.495 -1.669 . . . . 75.35 106.495 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 448' ' ' ARG . . . . . 0.54 ' HD3' ' NH2' ' A' ' 450' ' ' ARG . 20.1 ttm180 -115.4 125.45 53.17 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.052 -0.722 . . . . 61.41 109.052 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 8.7 mt -107.12 145.66 32.22 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 107.647 -1.242 . . . . 62.21 107.647 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' ARG . . . . . 0.54 ' NH2' ' HD3' ' A' ' 448' ' ' ARG . 2.7 ptp180 -149.31 130.81 14.82 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 121.08 0.467 . . . . 75.25 111.706 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 111.02 29.95 3.35 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.407 -0.815 . . . . 25.5 111.094 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 91.4 mt -70.6 133.12 86.93 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 111.665 0.246 . . . . 75.41 111.665 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.496 ' HA ' ' CZ ' ' A' ' 516' ' ' ARG . 31.3 Cg_exo -58.58 164.64 9.0 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 123.305 2.67 . . . . 72.35 113.389 175.004 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -77.47 100.15 5.91 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.964 -1.471 . . . . 70.14 108.179 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.61 32.62 0.02 OUTLIER 'General case' 0 C--N 1.277 -2.544 0 CA-C-N 111.756 -2.475 . . . . 73.12 111.421 173.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.85 113.62 3.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.024 -1.102 . . . . 61.5 108.024 171.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 72.8 p -84.26 170.47 13.67 Favored 'General case' 0 N--CA 1.426 -1.642 0 CA-C-O 120.98 0.419 . . . . 62.05 112.048 -173.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.587 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 35.9 pt -63.68 -24.85 36.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.689 -0.687 . . . . 70.25 110.255 174.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.86 -43.04 37.66 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.254 -0.647 . . . . 72.23 109.254 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' ASP . . . . . 0.535 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 7.9 t70 -69.64 -32.29 70.88 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.286 -0.87 . . . . 74.13 109.845 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.453 HG22 ' HA ' ' A' ' 458' ' ' ILE . 11.7 tt -74.53 -29.02 23.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 C-N-CA 120.293 -0.563 . . . . 73.21 110.288 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 85.6 mt -65.45 -36.06 82.76 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.564 -0.532 . . . . 70.4 109.564 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 463' ' ' ASP . . . . . 0.535 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 22.6 t70 -57.38 -56.23 24.48 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.371 -0.831 . . . . 63.21 109.074 171.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -53.3 -40.47 64.77 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 113.506 -1.679 . . . . 71.25 111.82 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 82.3 mt -73.26 -37.29 66.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.654 -0.703 . . . . 64.55 112.357 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.49 -137.16 39.62 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 119.762 -1.209 . . . . 72.54 112.09 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -57.43 -21.89 39.69 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 124.632 1.173 . . . . 73.43 112.354 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -69.39 -10.14 56.62 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.372 0.508 . . . . 71.22 112.372 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -65.98 -15.22 62.81 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.353 0.597 . . . . 73.23 110.933 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 13.9 m -87.54 -14.87 39.07 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-O 121.115 0.483 . . . . 64.21 111.014 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.2 6.69 20.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.64 0.978 . . . . 64.44 113.64 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 8.9 tt -90.58 151.47 3.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 N-CA-C 108.524 -0.917 . . . . 74.33 108.524 175.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -78.78 148.18 33.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.093 -0.706 . . . . 63.35 109.093 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 29.1 m -51.43 109.97 0.4 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.359 1.064 . . . . 64.34 112.777 -175.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 34.6 m170 64.13 28.68 14.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.509 1.124 . . . . 73.42 110.707 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.42 20.58 8.57 Favored Glycine 0 N--CA 1.43 -1.74 0 CA-C-N 114.986 -1.006 . . . . 42.2 113.453 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.83 106.15 17.57 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 N-CA-C 106.67 -1.604 . . . . 64.42 106.67 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -114.35 93.27 4.27 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 109.153 -0.684 . . . . 74.44 109.153 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' MET . . . . . 0.402 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 1.5 pmm? -83.82 142.68 30.46 Favored 'General case' 0 C--N 1.294 -1.844 0 C-N-CA 120.564 -0.455 . . . . 64.33 109.935 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 57.3 t -76.74 124.92 35.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 106.581 -1.637 . . . . 74.1 106.581 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.23 154.95 18.55 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.16 0.505 . . . . 70.33 109.996 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -96.04 172.02 8.26 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 105.775 -1.935 . . . . 71.33 105.775 176.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -65.51 -5.18 7.22 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.693 0.997 . . . . 65.51 113.693 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' GLN . . . . . 0.472 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 36.2 tt0 -92.56 -1.11 57.17 Favored 'General case' 0 CA--C 1.555 1.17 0 CA-C-O 121.984 0.897 . . . . 70.23 109.25 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.19 30.65 62.56 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.629 -0.714 . . . . 65.14 112.83 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.472 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 93.9 mtt180 -127.81 148.6 67.7 Favored Pre-proline 0 C--N 1.306 -1.287 0 N-CA-C 107.905 -1.146 . . . . 71.44 107.905 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.92 133.45 54.82 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.08 2.52 . . . . 54.42 113.531 -177.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.9 m -73.73 -17.91 61.06 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 123.888 0.875 . . . . 73.1 111.165 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 118.02 -20.14 10.79 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 110.444 -1.062 . . . . 64.12 110.444 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -108.33 148.52 29.94 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 106.543 -1.651 . . . . 63.51 106.543 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.402 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -159.71 171.13 20.1 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 117.903 0.32 . . . . 55.04 110.803 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 492' ' ' PHE . . . . . 0.436 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 98.3 m-85 -128.55 151.08 49.85 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.605 -0.725 . . . . 63.53 109.511 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 50.7 mt -131.14 137.41 55.78 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.737 0 N-CA-C 105.849 -1.908 . . . . 62.55 105.849 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -110.72 115.89 30.35 Favored 'General case' 0 C--N 1.276 -2.622 0 C-N-CA 119.197 -1.001 . . . . 74.24 109.223 177.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.405 ' CG ' ' HB3' ' A' ' 500' ' ' ARG . 3.2 tpt -92.73 167.09 12.11 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.718 -1.128 . . . . 64.34 108.996 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.411 ' HB3' ' HG2' ' A' ' 500' ' ' ARG . 39.7 ttmt -53.24 -45.45 68.75 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.95 1.3 . . . . 75.21 112.295 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 22.6 m -147.65 168.4 22.14 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.282 -0.872 . . . . 61.2 110.0 -173.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.47 93.86 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 123.863 0.727 . . . . 73.53 111.911 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -69.2 -37.69 78.22 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 108.912 -0.773 . . . . 73.43 108.912 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' ARG . . . . . 0.411 ' HG2' ' HB3' ' A' ' 496' ' ' LYS . 0.0 OUTLIER -58.69 -47.75 83.45 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.228 -1.351 . . . . 71.4 110.2 175.268 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -64.02 -39.06 93.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 65.11 110.495 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.75 -44.87 95.07 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.653 -0.703 . . . . 74.21 110.878 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 26.4 ttt -69.0 -37.23 78.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.146 -0.479 . . . . 73.23 110.18 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.99 83.17 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.81 -0.632 . . . . 65.41 110.515 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.85 -38.96 87.38 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.191 -0.458 . . . . 61.24 110.65 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -66.91 -41.4 87.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.12 0.486 . . . . 51.33 109.987 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -64.34 -40.26 95.53 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.578 -0.737 . . . . 72.24 111.36 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' CYS . . . . . 0.401 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 22.9 m -107.86 13.77 26.02 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 113.252 0.834 . . . . 71.23 113.252 -173.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -67.89 98.29 0.73 Allowed 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.884 -0.51 . . . . 73.22 109.714 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 85.8 tttt 66.09 54.5 0.98 Allowed 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.95 1.3 . . . . 72.43 109.604 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 511' ' ' LYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 54.2 tptt -93.26 140.35 29.63 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.701 -1.59 . . . . 60.12 109.023 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -84.7 113.7 21.49 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-O 121.077 0.465 . . . . 75.31 109.815 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 23.9 ttt -94.41 93.3 7.59 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 105.345 -2.094 . . . . 61.44 105.345 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 13.3 mptt 68.1 -82.26 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.871 -1.059 . . . . 72.05 111.333 -173.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -131.77 0.45 3.93 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 112.077 0.399 . . . . 71.42 112.077 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' ARG . . . . . 0.496 ' CZ ' ' HA ' ' A' ' 453' ' ' PRO . 15.8 ttm180 -118.49 146.54 44.44 Favored 'General case' 0 C--N 1.298 -1.671 0 C-N-CA 119.848 -0.741 . . . . 55.41 109.166 -176.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -89.59 120.76 31.17 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 109.111 -0.7 . . . . 74.33 109.111 -177.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 71.2 t -107.39 115.11 47.95 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.825 0 N-CA-C 107.246 -1.391 . . . . 73.41 107.246 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -94.19 112.75 24.59 Favored 'General case' 0 C--N 1.285 -2.21 0 N-CA-C 108.287 -1.005 . . . . 74.21 108.287 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -105.2 128.7 58.89 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.084 0 CA-C-N 115.439 -0.801 . . . . 63.42 110.373 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -128.83 159.55 35.39 Favored 'General case' 0 C--O 1.211 -0.924 0 C-N-CA 123.309 0.643 . . . . 71.05 109.302 -178.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.22 143.92 25.79 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.401 -0.592 . . . . 62.32 109.401 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 7.3 p -141.6 171.1 14.52 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 122.872 0.469 . . . . 53.2 111.4 -177.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.9 m -98.64 144.89 27.43 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 115.698 -0.683 . . . . 74.44 111.261 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 525' ' ' ALA . . . . . 0.408 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -62.84 -31.91 73.02 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.817 0.673 . . . . 75.44 112.817 -177.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.69 -41.12 92.79 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.943 0.402 . . . . 74.14 110.469 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 527' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 531' ' ' VAL . 35.8 tt0 -72.2 -39.03 68.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.394 0.616 . . . . 71.44 109.358 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -62.66 -44.04 97.28 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.1 -0.954 . . . . 73.43 109.71 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -69.48 -30.29 68.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.198 0.523 . . . . 64.52 110.411 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -65.71 -45.2 83.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.616 -0.72 . . . . 72.42 109.575 178.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 527' ' ' GLU . 58.3 t -67.02 -38.62 81.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.98 -0.555 . . . . 63.22 110.08 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 65.5 mt -67.15 -25.07 65.98 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.013 0.435 . . . . 75.3 111.487 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 27.1 ttt -87.32 -0.32 56.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.712 0.768 . . . . 71.34 110.691 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 65.39 37.83 94.27 Favored Glycine 0 C--N 1.305 -1.17 0 CA-C-N 114.975 -1.011 . . . . 55.33 111.425 -177.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -64.92 136.14 37.96 Favored Glycine 0 N--CA 1.413 -2.882 0 CA-C-N 115.196 -0.502 . . . . 63.21 113.525 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 25.6 m -96.61 131.12 43.58 Favored 'General case' 0 N--CA 1.418 -2.038 0 N-CA-C 108.211 -1.033 . . . . 65.22 108.211 177.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -120.69 125.56 47.98 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.617 -1.253 . . . . 43.43 107.617 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -126.89 92.79 3.61 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.242 0.544 . . . . 71.24 111.782 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -92.3 101.46 13.95 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 105.402 -2.073 . . . . 72.45 105.402 169.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.582 ' H ' HD23 ' A' ' 540' ' ' LEU . 1.9 pt? -103.37 136.52 42.97 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 114.67 1.359 . . . . 74.44 114.67 -167.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 . . . . . 0 N--CA 1.418 -2.07 0 N-CA-C 105.517 -2.031 . . . . 73.22 105.517 175.626 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.714 0 N-CA-C 108.49 -0.929 . . . . 74.31 108.49 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -65.27 117.99 5.06 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.205 1.937 . . . . 73.34 110.47 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -69.26 -40.06 6.63 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.397 2.065 . . . . 75.14 111.451 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.8 m -107.69 127.5 53.73 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.61 -0.885 . . . . 74.32 108.61 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 442' ' ' ASN . . . . . 0.45 ' HA ' ' HB3' ' A' ' 525' ' ' ALA . 53.8 m-80 -97.24 92.97 6.26 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.603 0.716 . . . . 63.34 111.771 -178.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 443' ' ' VAL . . . . . 0.474 ' HB ' ' OD2' ' A' ' 445' ' ' ASP . 25.5 t -116.9 166.35 11.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 N-CA-C 107.273 -1.38 . . . . 73.15 107.273 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.555 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.0 mtp85 -84.63 52.53 2.41 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 122.154 0.978 . . . . 73.42 109.731 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 445' ' ' ASP . . . . . 0.474 ' OD2' ' HB ' ' A' ' 443' ' ' VAL . 3.3 p30 -101.65 2.47 38.79 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.801 -1.091 . . . . 71.11 111.023 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 23.3 m -110.96 141.31 44.58 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 118.869 -1.132 . . . . 40.11 109.012 -174.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -120.62 144.17 30.32 Favored 'Isoleucine or valine' 0 C--N 1.26 -3.318 0 N-CA-C 107.704 -1.221 . . . . 61.2 107.704 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 448' ' ' ARG . . . . . 0.549 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 28.0 ttp180 -119.67 124.97 47.57 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.333 0.587 . . . . 73.01 109.815 173.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 8.6 mt -93.75 133.54 37.02 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 105.907 -1.886 . . . . 75.33 105.907 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 450' ' ' ARG . . . . . 0.453 ' C ' ' HD3' ' A' ' 450' ' ' ARG . 2.0 tmt_? -128.17 130.96 48.87 Favored 'General case' 0 C--N 1.277 -2.586 0 CA-C-O 121.221 0.534 . . . . 74.01 109.667 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.438 ' O ' HG22 ' A' ' 518' ' ' VAL . . . 95.48 47.92 2.46 Favored Glycine 0 C--N 1.283 -2.365 0 N-CA-C 110.248 -1.141 . . . . 34.24 110.248 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 83.3 mt -72.63 148.69 90.34 Favored Pre-proline 0 C--N 1.312 -1.035 0 N-CA-C 111.763 0.282 . . . . 73.42 111.763 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.04 179.35 0.8 Allowed 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.701 2.267 . . . . 65.23 111.161 173.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -77.74 87.61 3.99 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 115.527 -0.761 . . . . 72.25 111.631 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 63.88 41.83 6.44 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 113.045 -1.889 . . . . 73.24 111.427 169.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -50.0 125.28 11.71 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 114.999 -1.0 . . . . 71.23 108.414 171.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 1.6 p -72.24 162.46 29.44 Favored 'General case' 0 N--CA 1.419 -1.99 0 N-CA-C 113.409 0.892 . . . . 73.12 113.409 -170.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.462 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.1 pt -60.25 -27.54 39.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 113.871 1.063 . . . . 73.25 113.871 -172.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.77 -26.68 34.25 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.129 -1.028 . . . . 65.51 110.38 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 460' ' ' ASP . . . . . 0.594 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 5.2 t70 -78.34 -28.48 47.24 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.019 -0.537 . . . . 75.14 110.462 -178.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.418 HG22 ' O ' ' A' ' 458' ' ' ILE . 15.4 tt -70.18 -32.04 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 C-N-CA 119.617 -0.833 . . . . 73.1 108.832 175.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 88.3 mt -70.71 -36.07 73.05 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.311 0.577 . . . . 72.32 109.507 176.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 463' ' ' ASP . . . . . 0.594 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 6.3 t70 -55.48 -55.96 25.8 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.746 -1.115 . . . . 72.23 108.825 173.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 113.749 -1.569 . . . . 75.15 111.598 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 57.9 mt -67.42 -29.96 69.59 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 113.062 0.764 . . . . 64.24 113.062 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.95 -137.92 26.15 Favored Glycine 0 N--CA 1.425 -2.066 0 C-N-CA 119.161 -1.495 . . . . 14.44 111.72 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -58.09 -28.12 64.3 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.699 -0.75 . . . . 63.22 112.372 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -70.67 -11.2 60.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.24 0.459 . . . . 72.25 112.24 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -64.44 -22.22 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.175 0.805 . . . . 34.44 113.175 -176.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 11.7 t -101.7 -3.15 28.71 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.618 0.723 . . . . 71.03 110.49 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.99 3.27 41.42 Favored 'General case' 0 C--O 1.245 0.841 0 CA-C-O 121.235 0.541 . . . . 72.5 111.319 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 10.4 tt -75.49 148.49 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.287 0 N-CA-C 107.627 -1.249 . . . . 75.23 107.627 173.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 62.2 mtm180 -79.38 164.85 23.7 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 120.113 -0.635 . . . . 75.41 110.967 176.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 8.8 m -52.87 107.12 0.2 Allowed 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.973 0.909 . . . . 71.23 112.128 -174.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 60.88 27.7 17.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.119 0.968 . . . . 64.14 111.629 177.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -72.85 -1.45 55.0 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.106 -0.952 . . . . 43.01 114.576 -176.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.8 p -86.42 115.26 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 CA-C-O 121.866 0.841 . . . . 64.41 109.622 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -124.64 96.77 5.02 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.851 -0.613 . . . . 61.03 109.85 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' MET . . . . . 0.489 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 62.0 mtt -77.75 133.97 38.16 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.477 -0.934 . . . . 73.35 108.477 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 58.5 t -78.12 101.57 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.314 0 N-CA-C 107.551 -1.277 . . . . 61.42 107.551 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 73.8 mt -93.35 156.67 16.65 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-N 115.495 -0.775 . . . . 45.11 110.309 -177.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -103.31 179.76 4.18 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 105.878 -1.897 . . . . 73.24 105.878 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -55.57 -38.72 69.73 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 124.054 0.941 . . . . 54.51 112.424 -174.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -75.93 -1.85 27.52 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.274 0.559 . . . . 74.14 111.941 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 78.69 31.95 42.99 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.783 -0.722 . . . . 45.12 111.898 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -118.01 139.78 27.02 Favored Pre-proline 0 C--N 1.307 -1.264 0 N-CA-C 107.577 -1.268 . . . . 74.05 107.577 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.47 134.17 49.96 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.051 1.834 . . . . 73.3 110.987 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.8 m -75.94 1.87 14.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.647 0.737 . . . . 53.31 110.929 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.71 -30.76 6.23 Favored Glycine 0 CA--C 1.49 -1.481 0 CA-C-N 115.452 -0.794 . . . . 73.31 112.145 175.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' ASP . . . . . 0.479 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.1 p-10 -113.45 149.9 33.56 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-O 121.184 0.516 . . . . 55.12 111.639 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -150.75 155.56 39.52 Favored 'General case' 0 C--O 1.204 -1.31 0 CA-C-N 115.497 -0.774 . . . . 55.3 109.533 -177.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 492' ' ' PHE . . . . . 0.549 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 81.5 m-85 -111.28 146.09 37.62 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-O 121.189 0.519 . . . . 65.15 111.42 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 61.1 mt -126.51 122.13 60.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 106.52 -1.659 . . . . 75.43 106.52 172.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -100.96 114.08 27.65 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 115.633 -0.712 . . . . 64.53 109.907 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 94.9 mmm -92.88 172.94 8.01 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.4 0.619 . . . . 64.14 111.419 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -75.51 -40.47 57.03 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.045 -0.979 . . . . 74.1 110.192 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 41.5 t -140.98 150.81 43.56 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 116.268 -0.423 . . . . 73.4 110.289 -175.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.56 -29.79 70.45 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 123.969 0.908 . . . . 73.41 112.324 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -64.08 -42.84 96.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.868 0.842 . . . . 74.02 109.693 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -68.53 -38.73 81.09 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 114.534 -1.212 . . . . 72.13 110.463 177.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.35 90.81 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.891 -0.595 . . . . 53.02 110.975 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -68.78 -42.26 77.67 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.848 -0.427 . . . . 74.14 109.848 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 51.1 ttm -64.26 -40.91 96.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.987 -0.551 . . . . 74.41 110.486 -177.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.37 -39.95 81.61 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 116.226 -0.443 . . . . 54.13 110.188 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.89 -37.22 81.5 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 116.17 -0.468 . . . . 65.01 111.123 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -65.32 -44.58 87.39 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.944 -0.391 . . . . 54.54 109.944 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -66.09 -39.95 90.4 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.87 -0.605 . . . . 72.33 110.583 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 38.2 m -99.43 12.38 36.53 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 113.259 0.837 . . . . 74.32 113.259 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -70.23 95.69 1.03 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.365 -0.834 . . . . 63.31 109.891 176.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.1 tttt 64.33 62.65 0.81 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.977 1.711 . . . . 75.41 110.056 -177.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -108.14 148.56 29.68 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 112.641 -2.072 . . . . 61.23 108.803 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -77.12 119.87 21.42 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.176 0.512 . . . . 62.45 110.221 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.6 ttt -103.98 80.32 1.73 Allowed 'General case' 0 N--CA 1.404 -2.729 0 N-CA-C 105.584 -2.006 . . . . 61.23 105.584 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 514' ' ' LYS . . . . . 0.501 ' HD2' ' N ' ' A' ' 514' ' ' LYS . 0.1 OUTLIER 68.8 -75.75 0.06 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 113.601 -1.636 . . . . 72.34 112.204 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -106.09 -31.79 8.55 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 113.292 0.849 . . . . 54.55 113.292 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -110.61 157.79 19.3 Favored 'General case' 0 C--N 1.273 -2.719 0 CA-C-N 115.788 -0.642 . . . . 74.31 110.542 -168.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -95.32 126.89 40.94 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.467 -1.679 . . . . 54.51 106.467 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 451' ' ' GLY . 66.7 t -114.06 120.28 63.42 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.678 0 N-CA-C 108.795 -0.817 . . . . 73.42 108.795 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.83 112.47 22.51 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 107.785 -1.191 . . . . 75.2 107.785 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -103.69 129.68 55.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 109.963 -0.384 . . . . 53.32 109.963 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.662 -0.699 . . . . 74.2 109.244 -177.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 522' ' ' GLN . . . . . 0.465 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 42.0 tt0 -87.63 155.64 19.85 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.038 -1.097 . . . . 63.35 108.038 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 523' ' ' CYS . . . . . 0.465 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 7.9 p -162.05 171.69 17.12 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.461 0.648 . . . . 74.11 110.942 -178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 60.3 p -91.88 155.35 18.25 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.104 -0.953 . . . . 72.44 110.167 177.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 525' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 442' ' ' ASN . . . -55.67 -27.82 52.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.316 -0.856 . . . . 71.54 111.433 176.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.32 -51.87 67.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 55.24 109.168 176.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.7 -37.42 87.27 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.338 -0.846 . . . . 74.23 109.883 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 528' ' ' MET . . . . . 0.456 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 24.8 ttt -61.56 -46.85 88.14 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.695 -0.684 . . . . 74.21 110.848 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -73.4 -28.97 62.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.925 -0.71 . . . . 73.32 109.639 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.33 -47.86 82.36 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 115.739 -0.664 . . . . 72.42 110.231 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.7 t -69.76 -34.54 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 120.826 -0.35 . . . . 75.14 110.276 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.3 mt -67.45 -30.78 70.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.903 0.382 . . . . 71.13 111.094 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 26.3 ttt -76.34 -12.13 60.02 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.131 0.967 . . . . 63.43 110.737 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 88.63 20.89 45.89 Favored Glycine 0 C--N 1.285 -2.288 0 CA-C-N 114.407 -1.27 . . . . 62.2 112.652 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . 77.35 -178.23 51.85 Favored Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 121.332 -0.461 . . . . 45.41 112.139 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 28.9 m -157.1 132.27 9.03 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.714 -1.217 . . . . 74.24 107.714 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 6.1 mp -93.53 89.12 6.15 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 107.477 -1.305 . . . . 60.12 107.477 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -101.62 82.36 2.28 Favored 'General case' 0 C--N 1.292 -1.932 0 CA-C-N 115.699 -0.682 . . . . 73.33 111.885 -173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -175.68 79.96 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.135 -0.939 . . . . 74.43 109.922 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.4 mp -111.42 81.34 1.43 Allowed 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.097 -1.446 . . . . 75.43 107.097 175.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 . . . . . 0 C--N 1.295 -1.791 0 N-CA-C 108.396 -0.964 . . . . 75.24 108.396 -175.357 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 438' ' ' MET . . . . . 0.425 ' HA ' ' HD3' ' A' ' 439' ' ' PRO . 65.0 mtt . . . . . 0 CA--C 1.504 -0.808 0 N-CA-C 109.258 -0.645 . . . . 75.42 109.258 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 439' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 438' ' ' MET . 11.7 Cg_exo -72.19 120.98 7.14 Favored 'Trans proline' 0 C--O 1.247 0.954 0 C-N-CA 122.144 1.896 . . . . 75.04 110.542 176.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -58.28 107.64 0.34 Allowed 'Trans proline' 0 C--N 1.359 1.126 0 C-N-CA 122.037 1.825 . . . . 72.03 109.529 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 27.1 m -85.2 84.84 7.55 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-O 121.993 0.902 . . . . 60.32 111.889 -173.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -119.6 137.31 53.94 Favored 'General case' 0 C--N 1.291 -1.957 0 CA-C-N 114.796 -1.093 . . . . 60.04 108.45 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.44 140.52 19.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.421 0 O-C-N 124.292 0.995 . . . . 74.05 109.465 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.542 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 54.4 mtm180 -80.87 63.78 5.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.805 0.812 . . . . 74.34 109.758 176.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 40.7 p-10 -95.79 4.21 53.08 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 115.31 -0.859 . . . . 64.04 110.012 -175.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.597 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 39.3 m -102.7 149.43 24.45 Favored 'General case' 0 N--CA 1.411 -2.419 0 CA-C-O 121.616 0.722 . . . . 75.21 110.618 -174.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 447' ' ' ILE . . . . . 0.64 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.4 mt -125.46 145.4 32.89 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.738 0 CA-C-N 114.608 -1.178 . . . . 54.53 107.95 178.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -119.83 120.37 36.27 Favored 'General case' 0 N--CA 1.416 -2.161 0 N-CA-C 106.472 -1.677 . . . . 75.2 106.472 172.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 13.0 mt -103.93 131.5 51.1 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 106.741 -1.578 . . . . 75.24 106.741 -178.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -132.82 142.98 49.25 Favored 'General case' 0 C--N 1.257 -3.415 0 N-CA-C 108.497 -0.927 . . . . 71.12 108.497 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 96.4 26.24 11.27 Favored Glycine 0 C--N 1.289 -2.03 0 C-N-CA 120.052 -1.07 . . . . 63.34 110.765 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 64.3 mt -72.95 144.25 85.07 Favored Pre-proline 0 C--N 1.304 -1.376 0 N-CA-C 109.276 -0.638 . . . . 64.51 109.276 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -55.41 161.13 7.75 Favored 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.883 2.389 . . . . 70.51 112.001 175.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -77.35 90.63 3.79 Favored 'General case' 0 N--CA 1.411 -2.417 0 CA-C-N 115.067 -0.97 . . . . 72.04 111.04 -177.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.11 29.93 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 112.085 -2.325 . . . . 74.14 112.672 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.15 140.79 52.66 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.3 -1.37 . . . . 74.5 107.3 170.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 68.2 p -86.43 174.39 9.02 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 120.345 -0.542 . . . . 72.03 111.709 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.429 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 72.0 mt -63.97 -37.37 79.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 108.998 -0.742 . . . . 74.04 108.998 177.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.15 -37.6 87.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.86 -0.609 . . . . 73.21 109.811 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -65.75 -42.85 90.43 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.806 -0.634 . . . . 65.11 110.706 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 9.3 tp -72.71 -33.39 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 119.98 -0.688 . . . . 71.2 110.681 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -68.88 -32.86 72.83 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.156 0.503 . . . . 63.13 109.668 177.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.77 -52.71 59.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-N 115.127 -0.942 . . . . 51.55 108.766 176.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.26 -41.29 79.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.078 -1.419 . . . . 62.3 111.325 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 67.9 mt -67.78 -32.6 73.29 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.892 -0.594 . . . . 73.2 111.859 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.06 -124.09 7.61 Favored Glycine 0 N--CA 1.418 -2.537 0 C-N-CA 119.377 -1.392 . . . . 63.44 113.129 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -42.58 -42.21 3.31 Favored 'General case' 0 C--N 1.287 -2.146 0 C-N-CA 126.693 1.997 . . . . 72.53 112.625 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -66.16 -12.37 55.43 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.359 -0.837 . . . . 52.03 112.785 -172.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.35 -15.7 60.93 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.406 0.622 . . . . 60.31 110.352 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.5 m -85.23 -28.03 25.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.63 0.729 . . . . 53.23 110.238 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -106.75 15.68 25.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.906 0.86 . . . . 74.02 110.631 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -68.43 142.6 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 N-CA-C 108.856 -0.794 . . . . 62.43 108.856 176.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.15 143.36 33.93 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 106.142 -1.799 . . . . 70.32 106.142 178.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 22.3 m -54.8 106.86 0.24 Allowed 'General case' 0 C--N 1.298 -1.635 0 O-C-N 124.254 0.971 . . . . 75.11 111.944 -172.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 27.0 m170 60.72 35.03 19.79 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.026 0.93 . . . . 73.4 111.729 -177.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -83.41 -0.39 90.02 Favored Glycine 0 N--CA 1.432 -1.625 0 CA-C-N 115.004 -0.998 . . . . 65.12 111.422 175.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 5.5 p -82.06 127.86 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 CA-C-O 121.221 0.534 . . . . 73.4 110.05 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -138.77 96.83 3.2 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.054 -1.091 . . . . 73.14 108.054 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 479' ' ' MET . . . . . 0.507 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 55.4 ttm -78.24 139.75 38.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.366 -0.605 . . . . 74.5 109.366 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 74.7 t -94.29 110.61 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.726 0 CA-C-O 122.105 0.955 . . . . 73.21 111.136 -176.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.47 HD23 ' H ' ' A' ' 481' ' ' LEU . 0.7 OUTLIER -104.59 159.8 15.46 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.189 -1.368 . . . . 70.23 108.142 175.126 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -114.04 -168.97 1.43 Allowed 'General case' 0 C--N 1.273 -2.742 0 N-CA-C 108.435 -0.95 . . . . 72.35 108.435 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 31.9 t60 -54.14 -28.71 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 124.006 0.922 . . . . 61.31 111.97 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -75.01 -12.69 60.39 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.01 0.433 . . . . 73.42 110.888 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 79.76 25.18 58.83 Favored Glycine 0 N--CA 1.433 -1.554 0 N-CA-C 112.122 -0.391 . . . . 64.31 112.122 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -130.66 149.87 74.79 Favored Pre-proline 0 C--N 1.308 -1.207 0 N-CA-C 107.129 -1.434 . . . . 71.02 107.129 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' PRO . . . . . 0.507 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 12.3 Cg_endo -57.35 130.48 39.46 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.379 2.053 . . . . 73.41 111.576 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 16.3 m -81.35 9.07 7.73 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.299 -0.864 . . . . 74.52 111.033 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 80.6 23.33 60.45 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 109.871 -1.292 . . . . 61.45 109.871 -176.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -142.13 141.25 32.66 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.508 -1.293 . . . . 70.45 107.508 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.51 160.29 28.96 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 122.556 0.342 . . . . 53.51 110.31 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -118.97 144.41 46.5 Favored 'General case' 0 C--N 1.291 -1.974 0 N-CA-C 109.189 -0.671 . . . . 75.22 109.189 175.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.5 131.52 44.24 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 107.577 -1.268 . . . . 72.15 107.577 174.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.597 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 33.6 tt0 -104.98 131.94 51.87 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 108.165 -1.05 . . . . 70.51 108.165 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.64 ' SD ' HD11 ' A' ' 447' ' ' ILE . 67.9 mtp -104.43 178.07 4.67 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 123.008 0.523 . . . . 73.34 110.241 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -74.3 -36.05 63.72 Favored 'General case' 0 N--CA 1.407 -2.592 0 C-N-CA 123.329 0.652 . . . . 74.35 111.841 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 69.3 m -144.64 153.66 41.99 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 113.085 0.772 . . . . 63.11 113.085 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.05 68.77 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.523 1.129 . . . . 55.01 111.98 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.56 -49.3 77.93 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 115.783 -0.644 . . . . 72.21 111.62 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.85 -28.7 55.58 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.298 -0.561 . . . . 65.34 111.552 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.67 -43.57 96.31 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.512 0.507 . . . . 73.1 109.858 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -69.3 -38.86 78.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.314 0.578 . . . . 75.03 109.457 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.92 -44.01 97.78 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.285 -0.87 . . . . 42.43 109.622 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.8 97.97 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.877 -0.601 . . . . 35.0 110.6 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -71.58 -22.94 61.66 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 112.079 0.4 . . . . 64.21 112.079 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -85.72 -42.17 14.48 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.602 -0.518 . . . . 64.33 109.602 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -70.48 -38.47 74.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.84 -0.618 . . . . 70.04 109.997 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 56.6 m -107.84 23.8 13.91 Favored 'General case' 0 N--CA 1.421 -1.885 0 CA-C-N 115.831 -0.622 . . . . 62.42 110.92 -177.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' HIS . . . . . 0.449 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 29.3 t-80 -64.93 97.25 0.22 Allowed 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.606 -0.887 . . . . 71.21 108.606 172.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 97.9 mttt 59.32 62.55 1.77 Allowed 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.362 1.065 . . . . 71.32 110.341 -179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -103.71 134.04 47.69 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 114.919 -1.037 . . . . 71.43 109.049 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -73.32 133.33 43.83 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 116.013 -0.54 . . . . 61.11 110.919 -176.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.8 ttt -126.37 104.31 8.11 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 107.95 -1.13 . . . . 70.01 107.95 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.29 -72.66 0.1 Allowed 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 124.825 1.25 . . . . 75.45 110.782 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -141.16 -13.12 0.92 Allowed 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 112.754 0.65 . . . . 54.02 112.754 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' ARG . . . . . 0.409 ' HD3' ' N ' ' A' ' 517' ' ' TYR . 0.0 OUTLIER -124.92 149.72 47.3 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 108.246 -1.02 . . . . 73.11 108.246 -174.388 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 517' ' ' TYR . . . . . 0.409 ' N ' ' HD3' ' A' ' 516' ' ' ARG . 55.7 m-85 -88.25 128.56 35.47 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 112.714 0.635 . . . . 72.41 112.714 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 91.2 t -96.2 112.39 28.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.128 -1.396 . . . . 72.23 107.343 176.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -97.59 114.78 26.77 Favored 'General case' 0 C--N 1.269 -2.892 0 N-CA-C 106.973 -1.492 . . . . 74.51 106.973 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 78.4 t -104.08 123.71 58.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.883 -0.599 . . . . 73.31 109.884 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -121.63 147.92 45.23 Favored 'General case' 0 C--O 1.208 -1.116 0 C-N-CA 124.003 0.921 . . . . 73.34 108.842 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -95.66 152.43 18.46 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.226 0.466 . . . . 73.02 110.939 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.4 m -152.15 170.71 19.31 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 123.128 0.571 . . . . 73.51 110.592 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 35.1 t -105.38 156.78 17.85 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 116.212 -0.449 . . . . 63.14 109.976 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 525' ' ' ALA . . . . . 0.473 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -57.73 -42.89 84.77 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.217 0.451 . . . . 72.13 112.217 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.09 -31.49 70.26 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.68 0.753 . . . . 72.44 109.46 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -72.61 -37.26 68.15 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.999 -1.0 . . . . 51.42 110.678 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 42.8 ttm -61.44 -44.88 96.33 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.655 -0.868 . . . . 62.4 108.655 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' ASN . . . . . 0.407 ' O ' ' HG2' ' A' ' 533' ' ' MET . 8.6 t30 -62.41 -38.08 88.29 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.797 -1.092 . . . . 72.42 110.21 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -58.3 -47.89 82.24 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.691 0.796 . . . . 54.42 109.925 177.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.79 -34.42 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.174 0.511 . . . . 54.43 110.302 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 85.0 mt -71.21 -27.64 63.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.355 -0.384 . . . . 64.35 111.722 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 529' ' ' ASN . 24.6 mmt -81.17 7.28 11.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.169 0.509 . . . . 72.02 110.898 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 72.17 28.21 68.68 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.33 -0.85 . . . . 24.43 110.995 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . 95.24 157.78 32.49 Favored Glycine 0 N--CA 1.414 -2.789 0 N-CA-C 109.726 -1.35 . . . . 74.32 109.726 -176.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 21.2 m -136.9 120.43 17.11 Favored 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 108.984 -0.747 . . . . 54.24 108.984 178.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 84.8 mt -102.99 92.19 4.45 Favored 'General case' 0 C--N 1.281 -2.399 0 N-CA-C 107.733 -1.21 . . . . 70.02 107.733 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -96.15 159.23 15.06 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 116.068 -0.515 . . . . 51.02 109.657 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -106.06 164.4 12.01 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-N 115.781 -0.645 . . . . 74.03 109.515 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 6.8 mp -89.76 86.56 6.7 Favored 'General case' 0 C--N 1.289 -2.064 0 CA-C-O 121.376 0.608 . . . . 71.24 109.741 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 . . . . . 0 N--CA 1.425 -1.697 0 CA-C-N 114.882 -1.053 . . . . 72.14 109.475 178.013 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 CA--C 1.511 -0.55 0 N-CA-C 109.321 -0.622 . . . . 72.13 109.321 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -64.95 140.15 65.03 Favored 'Trans proline' 0 C--O 1.245 0.827 0 C-N-CA 122.19 1.927 . . . . 71.11 111.366 175.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -55.69 126.72 23.4 Favored 'Trans proline' 0 C--O 1.242 0.699 0 C-N-CA 122.746 2.298 . . . . 72.23 110.385 175.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.8 m 63.03 56.14 1.85 Allowed 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 122.544 1.164 . . . . 73.34 109.302 -176.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 442' ' ' ASN . . . . . 0.401 HD22 ' HB3' ' A' ' 525' ' ' ALA . 60.9 t30 -67.08 164.65 17.46 Favored 'General case' 0 C--O 1.25 1.108 0 CA-C-N 114.251 -1.34 . . . . 75.43 110.053 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 39.0 t -55.22 142.1 10.3 Favored 'Isoleucine or valine' 0 C--O 1.252 1.211 0 C-N-CA 124.177 0.991 . . . . 71.42 111.927 -174.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.567 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 98.6 mtt180 -89.5 70.26 7.96 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.099 -0.955 . . . . 74.03 109.991 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -123.22 18.7 9.9 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.256 -1.338 . . . . 72.14 110.497 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 63.6 m -113.43 156.82 22.81 Favored 'General case' 0 N--CA 1.417 -2.116 0 C-N-CA 119.682 -0.807 . . . . 75.5 109.424 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -129.18 139.11 52.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 N-CA-C 108.508 -0.923 . . . . 75.31 108.508 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 -108.2 120.93 43.77 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 107.045 -1.465 . . . . 73.11 107.045 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.486 HD22 HG22 ' A' ' 520' ' ' VAL . 12.3 mt -100.11 145.54 27.85 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.848 -1.538 . . . . 70.24 106.848 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -141.15 137.06 32.45 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 109.998 -0.371 . . . . 73.43 109.998 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 94.41 34.45 6.36 Favored Glycine 0 C--N 1.298 -1.548 0 CA-C-N 115.964 -0.562 . . . . 75.12 113.047 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 88.1 mt -75.3 150.31 85.03 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 116.881 0.341 . . . . 43.55 111.159 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.7 156.24 58.61 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 C-N-CA 122.868 2.379 . . . . 61.41 112.207 176.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -75.31 93.63 2.91 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.029 -1.442 . . . . 75.14 109.731 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 85.07 38.71 0.02 OUTLIER 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 111.841 -2.436 . . . . 75.14 111.388 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.24 137.49 57.04 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.205 -1.035 . . . . 74.2 108.205 169.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 15.4 p -81.5 156.93 25.03 Favored 'General case' 0 N--CA 1.416 -2.156 0 CA-C-N 116.66 -0.246 . . . . 65.21 110.535 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.464 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 63.3 mt -63.17 -32.52 56.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.746 0.784 . . . . 71.41 109.202 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -67.27 -36.14 80.97 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.486 -0.779 . . . . 71.21 110.216 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.08 -35.83 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.185 -0.462 . . . . 63.24 110.372 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.456 HG22 ' HA ' ' A' ' 458' ' ' ILE . 12.5 tt -73.35 -33.47 40.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 120.443 -0.503 . . . . 71.22 110.286 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.3 mt -67.71 -35.46 78.83 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.409 0.623 . . . . 72.32 109.526 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.28 -49.85 74.03 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-N 115.213 -0.903 . . . . 72.3 109.45 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -51.88 -44.97 63.95 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.025 -1.443 . . . . 74.2 111.002 177.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.9 -36.56 83.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.388 -0.823 . . . . 73.23 111.648 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 72.87 -132.17 16.9 Favored Glycine 0 CA--C 1.476 -2.367 0 C-N-CA 120.396 -0.907 . . . . 74.43 111.246 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -52.32 -36.37 53.11 Favored 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 124.973 1.309 . . . . 72.44 109.795 176.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -70.33 -5.8 30.57 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.101 -0.954 . . . . 73.22 112.756 -176.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -72.85 -15.51 61.61 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.421 0.629 . . . . 74.42 109.769 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 28.5 m -91.06 -16.91 27.1 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 121.748 0.785 . . . . 55.31 109.263 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' ASP . . . . . 0.475 ' O ' ' HG3' ' A' ' 495' ' ' MET . 69.2 m-20 -98.26 0.15 45.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.84 -0.618 . . . . 73.25 112.549 -174.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 472' ' ' ILE . . . . . 0.411 ' HA ' ' HA ' ' A' ' 495' ' ' MET . 14.2 tt -79.06 158.39 4.7 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 N-CA-C 108.378 -0.971 . . . . 74.24 108.378 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -87.93 157.57 18.91 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.785 -1.191 . . . . 73.33 107.785 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.2 m -52.19 107.13 0.18 Allowed 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 124.028 0.931 . . . . 74.13 112.298 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 49.3 m80 61.94 29.08 17.7 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.298 1.039 . . . . 70.44 111.408 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -78.06 -3.11 84.41 Favored Glycine 0 N--CA 1.439 -1.159 0 CA-C-N 115.63 -0.714 . . . . 73.03 112.774 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.449 ' HA ' HG13 ' A' ' 493' ' ' ILE . 5.0 p -83.07 103.24 10.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.17 0 CA-C-O 121.507 0.67 . . . . 74.31 110.686 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -114.99 91.75 3.72 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 116.246 -0.434 . . . . 72.24 110.116 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' MET . . . . . 0.437 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 69.8 mtm -77.54 129.07 35.19 Favored 'General case' 0 CA--C 1.489 -1.392 0 N-CA-C 106.23 -1.767 . . . . 62.44 106.23 173.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.0 t -81.13 118.39 28.82 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-O 121.47 0.653 . . . . 72.0 110.523 -173.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 69.8 mt -96.59 152.84 18.25 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.451 -1.314 . . . . 72.04 107.451 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -92.59 -170.44 2.47 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 107.883 -1.154 . . . . 71.14 107.883 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -72.15 -5.2 33.84 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 124.022 0.929 . . . . 65.1 113.275 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -109.87 12.07 24.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-O 121.505 0.669 . . . . 53.44 109.525 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 68.05 31.78 75.69 Favored Glycine 0 CA--C 1.505 -0.558 0 CA-C-N 115.604 -0.725 . . . . 72.11 112.88 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -121.45 142.21 35.02 Favored Pre-proline 0 C--N 1.305 -1.342 0 N-CA-C 107.0 -1.482 . . . . 74.12 107.0 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -52.42 129.86 33.63 Favored 'Trans proline' 0 N--CA 1.477 0.53 0 C-N-CA 123.161 2.574 . . . . 72.42 113.373 -177.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.7 m -77.39 -20.76 54.2 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.859 -0.609 . . . . 53.54 110.118 178.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 114.58 -18.6 17.32 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.66 -0.7 . . . . 75.5 111.699 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -112.78 164.45 13.37 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 120.929 0.395 . . . . 52.15 110.244 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.437 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -155.17 160.28 40.78 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.628 -0.714 . . . . 53.54 109.083 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.52 120.27 25.09 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.518 -1.289 . . . . 74.33 107.518 174.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' ILE . . . . . 0.449 HG13 ' HA ' ' A' ' 477' ' ' VAL . 1.7 mp -111.9 132.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.256 0 N-CA-C 108.393 -0.966 . . . . 70.02 108.393 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -103.45 121.98 43.94 Favored 'General case' 0 C--N 1.258 -3.392 0 N-CA-C 108.022 -1.103 . . . . 71.33 108.022 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 471' ' ' ASP . 2.0 tpt -92.9 171.45 8.96 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.533 -0.758 . . . . 50.33 109.987 -173.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -74.57 -36.59 63.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.007 0.923 . . . . 75.2 109.941 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.2 m -146.51 152.11 38.46 Favored 'General case' 0 N--CA 1.423 -1.819 0 CA-C-N 115.799 -0.637 . . . . 34.41 109.797 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.62 -36.49 78.73 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.108 0.88 . . . . 72.2 111.765 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -61.08 -48.82 79.95 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 115.504 -0.771 . . . . 75.43 110.388 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -68.87 -31.08 69.77 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.556 -1.202 . . . . 74.0 112.294 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.27 -48.29 70.9 Favored 'General case' 0 C--N 1.309 -1.175 0 O-C-N 123.392 0.433 . . . . 73.15 110.041 175.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -66.88 -38.98 87.32 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 116.053 -0.522 . . . . 74.24 110.312 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 47.5 tpp -65.81 -41.28 92.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.99 -0.55 . . . . 65.35 110.532 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.08 77.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 120.902 0.382 . . . . 71.42 110.401 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.466 ' HA ' HG12 ' A' ' 520' ' ' VAL . . . -71.36 -36.98 71.66 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.864 -0.607 . . . . 73.41 111.799 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -46.29 68.1 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 107.588 -1.264 . . . . 73.3 107.588 177.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -62.86 -33.5 75.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.894 -1.048 . . . . 63.44 110.53 -177.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 61.9 m -116.05 19.66 14.86 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 114.83 1.419 . . . . 65.33 114.83 -176.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 509' ' ' HIS . . . . . 0.453 ' CD2' ' HD3' ' A' ' 510' ' ' LYS . 12.8 t60 -68.18 108.77 3.27 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 107.809 -1.182 . . . . 73.43 107.809 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.453 ' HD3' ' CD2' ' A' ' 509' ' ' HIS . 14.1 mptt 63.73 52.7 2.14 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 122.173 0.987 . . . . 53.21 110.45 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 511' ' ' LYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 21.9 tptm -89.11 139.63 30.27 Favored 'General case' 0 N--CA 1.412 -2.344 0 CA-C-N 114.539 -1.21 . . . . 74.25 109.194 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -76.9 121.93 24.12 Favored 'General case' 0 C--N 1.284 -2.248 0 N-CA-C 108.188 -1.042 . . . . 72.32 108.188 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -105.84 77.31 1.24 Allowed 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.428 -2.064 . . . . 63.54 105.428 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? 69.75 -81.94 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.812 -1.54 . . . . 65.51 110.022 -172.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -125.67 -4.88 7.05 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-O 122.135 0.969 . . . . 61.14 110.872 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -94.22 160.12 14.83 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.016 -1.476 . . . . 71.23 107.016 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -120.35 118.27 29.94 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.722 -1.584 . . . . 70.23 106.722 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 96.0 t -112.79 134.6 54.88 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.996 0 CA-C-O 121.539 0.685 . . . . 72.13 111.458 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' A' ' 449' ' ' LEU . 32.0 tt0 -95.5 114.31 26.06 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.399 -0.963 . . . . 74.12 108.399 176.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 520' ' ' VAL . . . . . 0.486 HG22 HD22 ' A' ' 449' ' ' LEU . 57.3 t -109.39 112.84 42.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 N-CA-C 107.729 -1.211 . . . . 60.32 107.729 176.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -128.31 123.39 33.9 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.218 -0.301 . . . . 64.02 111.751 -174.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' GLN . . . . . 0.41 ' OE1' ' HB3' ' A' ' 444' ' ' ARG . 0.6 OUTLIER -70.99 136.0 48.16 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.883 0.373 . . . . 72.2 110.928 -178.784 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 61.4 m -145.01 170.37 16.29 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 124.39 1.076 . . . . 75.24 109.307 -177.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.567 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 40.4 t -82.88 154.15 24.76 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.32 -0.622 . . . . 74.3 109.32 175.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 525' ' ' ALA . . . . . 0.401 ' HB3' HD22 ' A' ' 442' ' ' ASN . . . -65.24 -23.57 67.1 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.433 -0.803 . . . . 63.11 109.489 175.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.98 -45.3 93.08 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.226 -0.657 . . . . 72.03 109.226 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -64.32 -40.63 96.29 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.075 0.464 . . . . 71.34 109.874 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 528' ' ' MET . . . . . 0.483 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.9 ttt -60.07 -47.64 85.05 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.361 -0.836 . . . . 63.42 110.382 178.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.15 -37.92 84.61 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 115.322 -0.854 . . . . 60.51 110.072 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -63.02 -43.0 99.93 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.255 -0.884 . . . . 75.44 110.01 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.83 -37.15 72.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 120.776 -0.369 . . . . 71.55 110.442 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.1 mt -66.28 -26.06 67.16 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.913 0.387 . . . . 63.24 111.804 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 93.2 mmm -91.48 7.08 42.94 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.549 0.69 . . . . 64.02 111.266 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 69.73 22.65 76.88 Favored Glycine 0 C--N 1.311 -0.847 0 CA-C-N 115.409 -0.814 . . . . 71.25 112.869 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -65.52 132.3 35.19 Favored Glycine 0 N--CA 1.412 -2.929 0 O-C-N 123.592 0.231 . . . . 75.02 112.93 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.9 m -139.41 102.74 4.55 Favored 'General case' 0 N--CA 1.419 -2.001 0 N-CA-C 107.879 -1.156 . . . . 53.55 107.879 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 67.1 tp -110.34 127.73 55.2 Favored 'General case' 0 C--N 1.285 -2.214 0 CA-C-N 115.76 -0.655 . . . . 63.43 110.19 -176.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -140.35 151.58 45.12 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.406 -0.961 . . . . 72.13 108.406 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -128.28 104.23 7.62 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.583 -0.525 . . . . 73.31 109.583 176.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.9 tt -91.29 99.2 12.22 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 106.529 -1.656 . . . . 61.25 106.529 178.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 . . . . . 0 C--N 1.295 -1.8 0 N-CA-C 108.342 -0.985 . . . . 65.4 108.342 -178.923 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 59.0 mtt . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 108.308 -0.997 . . . . 62.32 108.308 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -62.55 121.76 9.85 Favored 'Trans proline' 0 C--O 1.246 0.897 0 C-N-CA 122.752 2.301 . . . . 63.24 112.795 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -79.03 83.07 2.34 Favored 'Trans proline' 0 N--CA 1.441 -1.574 0 C-N-CA 122.098 1.866 . . . . 63.02 108.532 172.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 2.0 p -69.73 97.96 1.14 Allowed 'General case' 0 N--CA 1.423 -1.808 0 CA-C-N 115.122 -0.944 . . . . 74.53 112.048 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 442' ' ' ASN . . . . . 0.574 ' OD1' ' HB2' ' A' ' 524' ' ' SER . 0.1 OUTLIER -143.59 164.54 30.1 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.087 -0.961 . . . . 75.24 109.086 179.721 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 22.1 t -108.76 151.51 11.02 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.245 0 N-CA-C 107.199 -1.408 . . . . 63.24 107.199 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.599 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 95.5 mtt180 -94.01 75.42 4.13 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 122.313 1.054 . . . . 73.33 108.32 174.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.1 p30 -122.3 10.62 9.95 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 113.39 -1.732 . . . . 74.12 111.456 -172.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 446' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 29.3 m -104.61 141.36 36.57 Favored 'General case' 0 N--CA 1.4 -2.947 0 N-CA-C 108.417 -0.957 . . . . 62.43 108.417 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -123.73 139.11 51.24 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.415 0 N-CA-C 107.766 -1.198 . . . . 60.15 107.766 -177.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' ARG . . . . . 0.467 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.4 ttp180 -114.38 123.95 50.74 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 108.948 -0.76 . . . . 71.44 108.948 175.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.441 ' CD1' HD11 ' A' ' 461' ' ' ILE . 5.6 mt -102.11 138.1 39.5 Favored 'General case' 0 C--N 1.285 -2.235 0 N-CA-C 106.387 -1.709 . . . . 73.22 106.387 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 63.0 ttp180 -132.38 125.06 29.94 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-O 121.168 0.508 . . . . 62.21 110.15 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.42 45.69 1.41 Allowed Glycine 0 C--N 1.272 -2.985 0 CA-C-N 115.1 -0.954 . . . . 75.25 111.111 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 92.9 mt -84.19 140.26 39.49 Favored Pre-proline 0 N--CA 1.433 -1.309 0 O-C-N 122.86 -0.2 . . . . 74.04 110.547 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.55 150.75 33.71 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 123.208 2.606 . . . . 73.35 112.713 176.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -72.97 103.4 3.75 Favored 'General case' 0 N--CA 1.396 -3.169 0 N-CA-C 107.304 -1.369 . . . . 72.2 107.304 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 91.94 33.37 0.01 OUTLIER 'General case' 0 C--N 1.279 -2.469 0 CA-C-N 111.254 -2.703 . . . . 65.45 112.446 175.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -71.44 109.17 5.25 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 107.17 -1.419 . . . . 73.2 107.17 168.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.7 p -75.23 167.79 21.24 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.71 0.291 . . . . 72.33 110.791 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 59.7 mt -63.85 -32.49 57.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.983 0.421 . . . . 74.44 110.392 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.84 -49.75 69.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.306 0.574 . . . . 73.22 109.563 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 34.1 t70 -67.32 -32.14 72.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.277 -0.874 . . . . 75.32 111.324 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.517 HG22 ' HA ' ' A' ' 458' ' ' ILE . 11.2 tt -75.94 -30.37 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 109.959 -0.385 . . . . 75.21 109.959 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.6 mt -68.53 -35.03 76.9 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.25 -0.648 . . . . 73.44 109.25 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 463' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 24.0 t70 -60.04 -51.68 68.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.21 -0.905 . . . . 72.22 109.242 173.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -55.16 -40.21 70.39 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.204 -1.362 . . . . 64.21 111.912 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.54 -31.96 73.3 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.982 -0.554 . . . . 75.32 111.911 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.83 -128.94 15.36 Favored Glycine 0 CA--C 1.474 -2.491 0 C-N-CA 120.447 -0.882 . . . . 54.54 111.922 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -58.93 -28.37 66.18 Favored 'General case' 0 C--N 1.273 -2.735 0 CA-C-N 113.802 -1.199 . . . . 72.12 111.698 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -75.74 -5.88 47.88 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 112.454 0.539 . . . . 65.44 112.454 -178.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.54 63.56 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.309 0.576 . . . . 53.33 111.422 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 16.4 m -97.85 -6.32 32.77 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 121.371 0.605 . . . . 64.12 109.971 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' ASP . . . . . 0.457 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 70.6 m-20 -99.22 -5.73 29.4 Favored 'General case' 0 C--O 1.242 0.69 0 O-C-N 121.94 -0.475 . . . . 44.43 112.2 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' ILE . . . . . 0.462 ' HA ' ' SD ' ' A' ' 495' ' ' MET . 13.0 tt -69.02 148.48 11.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 CA-C-N 115.273 -0.876 . . . . 71.53 109.897 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -72.28 173.39 8.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.132 -0.627 . . . . 62.11 110.499 176.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.9 m -62.05 102.83 0.31 Allowed 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.302 -0.863 . . . . 73.32 108.973 176.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 58.05 52.8 7.31 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.939 1.295 . . . . 74.0 108.281 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -73.72 -16.42 79.2 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.904 -1.044 . . . . 74.44 113.439 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.51 121.39 36.66 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-O 121.701 0.762 . . . . 74.32 111.45 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -132.95 106.84 7.92 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 107.515 -1.291 . . . . 73.35 107.515 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.9 mtt -88.12 139.57 30.37 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 120.214 -0.595 . . . . 74.43 110.306 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 61.8 t -83.54 107.19 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.481 -0.933 . . . . 62.41 108.481 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.7 mt -88.65 154.67 20.12 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 114.436 -1.256 . . . . 75.43 109.748 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -92.81 160.84 14.76 Favored 'General case' 0 C--N 1.284 -2.261 0 N-CA-C 104.72 -2.326 . . . . 73.42 104.72 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -64.51 -14.17 56.02 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 119.2 0.909 . . . . 75.54 112.031 -178.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' GLN . . . . . 0.404 ' OE1' ' HG3' ' A' ' 486' ' ' ARG . 34.9 tt0 -71.31 -16.72 62.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.414 0.685 . . . . 73.41 109.99 173.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.52 33.44 22.3 Favored Glycine 0 N--CA 1.435 -1.397 0 CA-C-O 121.941 0.745 . . . . 61.22 111.285 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.404 ' HG3' ' OE1' ' A' ' 484' ' ' GLN . 4.9 mmp_? -128.61 150.83 75.77 Favored Pre-proline 0 C--N 1.29 -1.98 0 N-CA-C 106.127 -1.805 . . . . 63.53 106.127 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.39 126.58 18.78 Favored 'Trans proline' 0 C--O 1.247 0.968 0 C-N-CA 121.587 1.524 . . . . 71.14 111.39 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 20.0 m -67.92 -24.86 65.24 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.605 0.716 . . . . 63.13 110.198 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 125.86 -20.15 6.44 Favored Glycine 0 N--CA 1.429 -1.784 0 N-CA-C 110.91 -0.876 . . . . 52.42 110.91 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -111.14 154.44 24.32 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.881 0.372 . . . . 61.11 110.752 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.59 40.81 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.286 -0.635 . . . . 63.35 109.286 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' PHE . . . . . 0.467 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 85.4 m-85 -118.36 137.48 53.08 Favored 'General case' 0 C--N 1.293 -1.871 0 N-CA-C 109.315 -0.624 . . . . 74.21 109.315 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 52.5 mt -125.3 124.95 68.27 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.202 0 N-CA-C 107.22 -1.4 . . . . 64.31 107.22 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -102.86 122.93 45.53 Favored 'General case' 0 C--N 1.27 -2.885 0 CA-C-N 115.683 -0.69 . . . . 71.14 110.247 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 472' ' ' ILE . 26.2 mmt -96.45 169.29 10.01 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 123.691 0.796 . . . . 75.42 111.608 -176.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -65.32 -32.47 74.14 Favored 'General case' 0 N--CA 1.421 -1.919 0 CA-C-N 115.492 -0.777 . . . . 64.32 112.737 178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 38.8 p -152.5 163.94 38.57 Favored 'General case' 0 C--O 1.25 1.106 0 CA-C-O 120.587 0.232 . . . . 72.15 111.389 -177.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.24 85.14 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 123.723 0.809 . . . . 63.41 111.443 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -54.45 -50.57 67.37 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.406 -0.816 . . . . 73.11 111.832 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' ARG . . . . . 0.457 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 2.4 mmp_? -64.53 -42.2 95.91 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 113.846 -1.524 . . . . 75.14 109.77 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.04 91.17 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.038 -0.983 . . . . 70.04 110.683 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -64.57 -41.62 96.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.816 -0.629 . . . . 54.32 110.893 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.0 mtp -74.09 -34.61 64.03 Favored 'General case' 0 CA--C 1.508 -0.64 0 C-N-CA 119.625 -0.83 . . . . 63.43 110.85 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.87 -40.4 79.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 116.25 -0.432 . . . . 71.33 110.09 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.7 -38.72 84.04 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 116.112 -0.494 . . . . 73.55 111.195 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -67.8 -42.38 81.66 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.497 -0.32 . . . . 74.11 110.927 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.4 -41.8 75.96 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 120.595 -0.442 . . . . 75.33 110.819 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 47.9 m -95.93 11.39 34.05 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 113.241 0.83 . . . . 65.31 113.241 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -66.17 97.6 0.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 O-C-N 121.324 -0.86 . . . . 74.42 110.861 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.496 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 21.6 ttmm 75.22 33.12 0.72 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.301 1.44 . . . . 71.22 109.484 175.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -80.59 150.4 29.53 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.462 -1.245 . . . . 73.14 109.817 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -80.15 143.56 33.77 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 120.69 0.281 . . . . 75.35 110.528 177.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.4 ttt -140.37 103.67 4.62 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.927 -1.138 . . . . 74.41 107.927 175.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp 66.81 -84.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 125.008 1.323 . . . . 63.42 111.013 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.31 -0.52 2.98 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.919 -0.771 . . . . 65.05 108.919 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -113.7 160.48 18.59 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.127 -1.064 . . . . 74.12 108.127 -172.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -113.45 118.85 35.65 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.659 -0.867 . . . . 70.12 108.659 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.85 112.66 35.73 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 CA-C-O 121.537 0.684 . . . . 64.12 109.558 -176.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' GLU . . . . . 0.496 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 42.0 mt-10 -94.49 112.32 24.09 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 107.724 -1.213 . . . . 74.12 107.724 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.7 t -104.53 127.91 58.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 CA-C-O 121.111 0.481 . . . . 71.41 111.938 -176.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.78 148.36 48.18 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.502 -0.772 . . . . 72.21 109.365 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -100.55 142.06 32.54 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 122.41 0.284 . . . . 65.22 110.453 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.7 p -147.61 173.68 12.48 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.456 0.646 . . . . 74.25 111.839 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 80.3 p -85.02 158.99 20.31 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.217 -0.901 . . . . 74.4 110.584 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 525' ' ' ALA . . . . . 0.552 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -64.67 -29.04 70.04 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.968 -0.56 . . . . 65.32 110.038 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -73.93 -35.77 64.62 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 116.047 -0.524 . . . . 74.42 110.313 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -64.42 -47.14 80.27 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.379 -0.971 . . . . 73.12 108.379 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 23.5 ttt -60.45 -42.98 97.27 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.511 -1.222 . . . . 62.13 109.969 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -60.72 -45.51 93.99 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.017 -0.992 . . . . 74.43 109.63 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.59 -40.86 98.03 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.865 0.364 . . . . 74.1 111.076 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.25 -39.8 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.339 0.59 . . . . 71.04 110.751 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt -81.9 -19.75 40.21 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.649 0.611 . . . . 72.45 112.649 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 25.9 ttt -85.31 5.67 29.57 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.996 0.903 . . . . 75.22 110.505 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 75.94 35.71 43.87 Favored Glycine 0 N--CA 1.434 -1.447 0 CA-C-N 114.901 -1.045 . . . . 52.14 112.494 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -70.34 146.78 43.04 Favored Glycine 0 N--CA 1.41 -3.047 0 N-CA-C 111.806 -0.518 . . . . 71.42 111.806 178.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 8.4 t -71.51 137.66 48.31 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.119 0.485 . . . . 70.24 109.791 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.78 80.47 1.77 Allowed 'General case' 0 N--CA 1.425 -1.687 0 CA-C-O 121.931 0.872 . . . . 73.31 109.22 -177.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -148.28 156.03 42.05 Favored 'General case' 0 C--N 1.288 -2.091 0 N-CA-C 107.198 -1.408 . . . . 73.32 107.198 175.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -131.08 116.59 17.95 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-O 121.12 0.486 . . . . 62.23 110.916 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 83.0 mt -120.7 81.72 1.81 Allowed 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 105.972 -1.862 . . . . 63.02 105.972 172.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 . . . . . 0 N--CA 1.467 0.388 0 C-N-CA 124.394 1.077 . . . . 53.53 110.584 -174.387 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 72.4 mtm . . . . . 0 C--O 1.238 0.477 0 N-CA-C 109.604 -0.517 . . . . 52.44 109.604 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -85.06 164.76 11.46 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.284 1.989 . . . . 61.25 111.374 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -58.59 119.86 7.38 Favored 'Trans proline' 0 C--O 1.247 0.945 0 C-N-CA 122.131 1.887 . . . . 71.14 108.461 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 6.3 t -111.95 114.14 26.87 Favored 'General case' 0 N--CA 1.412 -2.335 0 CA-C-O 122.229 1.014 . . . . 70.54 113.316 -170.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -87.82 95.57 10.14 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 104.312 -2.477 . . . . 15.21 104.312 168.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.95 153.57 6.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.729 0 CA-C-N 115.419 -0.81 . . . . 73.23 110.584 -171.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.579 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 69.0 ttt180 -83.88 68.23 9.89 Favored 'General case' 0 N--CA 1.41 -2.459 0 N-CA-C 108.806 -0.813 . . . . 74.24 108.806 174.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -119.66 16.38 12.79 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.229 1.012 . . . . 71.11 111.064 -178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 39.4 m -112.25 162.52 15.4 Favored 'General case' 0 N--CA 1.414 -2.257 0 N-CA-C 108.376 -0.972 . . . . 74.31 108.376 -176.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -128.18 138.42 54.73 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 N-CA-C 107.254 -1.387 . . . . 64.51 107.254 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -111.16 120.16 41.37 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 107.291 -1.374 . . . . 73.42 107.291 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.552 HD22 HG22 ' A' ' 520' ' ' VAL . 11.1 mt -97.56 139.16 33.88 Favored 'General case' 0 C--N 1.283 -2.314 0 N-CA-C 106.325 -1.731 . . . . 64.34 106.325 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -138.1 132.32 31.86 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 109.226 -0.657 . . . . 72.23 109.226 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 102.83 38.56 2.91 Favored Glycine 0 C--N 1.289 -2.073 0 N-CA-C 110.441 -1.064 . . . . 64.04 110.441 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.82 138.03 96.34 Favored Pre-proline 0 C--O 1.243 0.75 0 CA-C-N 115.434 -0.383 . . . . 70.21 111.761 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.11 171.93 6.92 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.339 2.693 . . . . 63.23 113.41 176.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -77.65 99.51 5.82 Favored 'General case' 0 N--CA 1.394 -3.25 0 CA-C-N 113.44 -1.709 . . . . 74.01 108.959 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 79.57 33.42 0.21 Allowed 'General case' 0 C--N 1.272 -2.778 0 CA-C-N 112.157 -2.292 . . . . 74.31 112.005 170.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.38 113.31 2.85 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.149 -1.056 . . . . 65.3 108.149 171.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.6 p -80.12 170.09 16.92 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 116.361 -0.381 . . . . 74.24 111.336 -175.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.5 pt -61.43 -34.45 61.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 N-CA-C 112.225 0.454 . . . . 73.1 112.225 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.12 -33.77 63.69 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 119.625 -0.83 . . . . 73.13 110.66 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.27 -37.71 74.94 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.038 0.447 . . . . 53.52 110.511 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.472 HG22 ' HA ' ' A' ' 458' ' ' ILE . 14.0 tt -70.65 -37.57 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 116.251 -0.431 . . . . 65.33 110.22 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 94.5 mt -67.62 -35.24 78.56 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.151 0.5 . . . . 74.1 110.121 177.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -62.95 -47.79 81.68 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.716 -0.675 . . . . 74.32 109.25 177.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -56.67 -42.87 79.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.562 -1.199 . . . . 71.42 110.938 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.77 -29.26 70.49 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.71 -0.677 . . . . 73.14 111.415 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.65 -121.13 21.41 Favored Glycine 0 CA--C 1.475 -2.468 0 CA-C-O 122.044 0.802 . . . . 63.43 113.088 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -51.75 -41.07 61.31 Favored 'General case' 0 C--N 1.266 -3.058 0 CA-C-N 112.675 -1.762 . . . . 61.42 111.405 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -82.36 1.87 35.09 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.608 -0.723 . . . . 64.52 112.52 -172.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -75.54 -15.67 60.35 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-O 121.078 0.466 . . . . 74.25 111.215 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 22.8 m -92.04 -14.47 29.29 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.342 0.592 . . . . 73.21 110.327 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' ASP . . . . . 0.455 ' CB ' ' HG2' ' A' ' 500' ' ' ARG . 2.9 m-20 -100.27 3.21 43.35 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 116.102 -0.499 . . . . 73.34 112.295 -176.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 472' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.6 tt -73.31 148.79 8.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 N-CA-C 108.26 -1.015 . . . . 63.33 108.26 176.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 473' ' ' ARG . . . . . 0.409 ' O ' HG12 ' A' ' 472' ' ' ILE . 71.8 mtp180 -79.21 156.99 27.92 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.95 -1.13 . . . . 71.3 107.95 174.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 2.0 p -61.15 110.82 1.49 Allowed 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 112.487 0.551 . . . . 71.33 112.487 -178.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 63.21 35.26 12.78 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.664 1.186 . . . . 61.43 108.899 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.85 -10.52 83.62 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 114.854 -1.066 . . . . 71.3 111.202 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.2 p -81.21 105.07 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-O 122.162 0.982 . . . . 55.3 110.654 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -113.11 98.85 7.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.05 -0.977 . . . . 74.21 109.809 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 67.8 mtm -82.15 130.99 35.23 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.995 -1.113 . . . . 55.22 107.995 177.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' VAL . . . . . 0.518 ' O ' ' HA ' ' A' ' 487' ' ' PRO . 52.3 t -82.98 122.14 36.99 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 107.378 -1.342 . . . . 64.22 107.378 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.9 mt -99.99 154.9 18.02 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.226 0.536 . . . . 54.03 110.948 -175.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -102.72 175.66 5.42 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 105.417 -2.068 . . . . 64.25 105.417 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -60.0 -24.91 64.84 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.389 0.541 . . . . 72.35 110.713 -178.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' GLN . . . . . 0.48 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 8.6 tt0 -68.29 -17.24 64.23 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 123.684 0.794 . . . . 73.31 111.095 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.24 28.9 35.18 Favored Glycine 0 N--CA 1.441 -1.002 0 CA-C-N 116.151 -0.477 . . . . 65.03 112.168 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.48 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 96.3 mtt180 -131.98 153.63 81.44 Favored Pre-proline 0 C--N 1.302 -1.474 0 N-CA-C 107.734 -1.21 . . . . 73.24 107.734 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 487' ' ' PRO . . . . . 0.518 ' HA ' ' O ' ' A' ' 480' ' ' VAL . 11.5 Cg_endo -56.32 133.25 56.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.514 2.143 . . . . 64.42 111.509 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 22.5 m -64.87 -12.57 50.21 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 123.751 0.82 . . . . 73.42 111.334 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 123.73 -12.72 8.24 Favored Glycine 0 CA--C 1.48 -2.108 0 N-CA-C 110.685 -0.966 . . . . 71.23 110.685 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' ASP . . . . . 0.412 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.6 p-10 -124.74 156.21 38.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-O 121.104 0.478 . . . . 72.24 110.601 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.5 150.79 29.97 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.195 -0.911 . . . . 70.11 108.751 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -112.04 127.87 56.02 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 108.906 -0.776 . . . . 75.14 108.906 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.54 128.75 73.8 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 107.921 -1.14 . . . . 73.41 107.921 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -104.29 124.36 49.03 Favored 'General case' 0 C--N 1.276 -2.589 0 CA-C-N 115.99 -0.55 . . . . 74.32 110.834 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -93.88 170.65 9.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.495 -0.775 . . . . 74.01 111.171 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -69.48 -28.54 66.16 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.87 -1.059 . . . . 73.02 110.097 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.5 m -154.42 151.16 28.66 Favored 'General case' 0 C--O 1.253 1.261 0 N-CA-C 109.332 -0.618 . . . . 74.31 109.332 -175.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.42 -25.71 68.1 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.119 0.968 . . . . 65.5 112.847 -177.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 499' ' ' ASP . . . . . 0.432 ' HB2' ' HD2' ' A' ' 500' ' ' ARG . 3.3 m-20 -54.69 -51.65 64.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.811 0.815 . . . . 74.53 110.083 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 500' ' ' ARG . . . . . 0.455 ' HG2' ' CB ' ' A' ' 471' ' ' ASP . 10.1 mpt_? -65.88 -38.0 87.64 Favored 'General case' 0 CA--C 1.496 -1.127 0 CA-C-N 114.426 -1.261 . . . . 74.23 110.381 -176.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.44 88.91 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.45 -0.795 . . . . 54.22 110.84 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' PHE . . . . . 0.412 ' HA ' ' HG3' ' A' ' 522' ' ' GLN . 66.2 t80 -68.66 -40.87 80.0 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.23 0.538 . . . . 61.42 110.177 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 66.6 mtt -70.31 -38.08 74.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.78 -0.646 . . . . 74.03 110.79 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.47 -41.98 83.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.305 -0.407 . . . . 64.21 110.37 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.46 ' HA ' HG12 ' A' ' 520' ' ' VAL . . . -67.41 -38.15 84.17 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 116.365 -0.38 . . . . 71.14 110.827 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -70.39 -39.51 74.47 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.747 -0.381 . . . . 73.21 111.1 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.57 -28.49 56.26 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.014 0.435 . . . . 74.42 111.128 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 39.7 m -114.99 18.56 16.31 Favored 'General case' 0 C--O 1.254 1.294 0 N-CA-C 113.13 0.789 . . . . 73.05 113.13 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -68.51 106.6 2.61 Favored 'General case' 0 C--O 1.243 0.715 0 O-C-N 121.052 -1.03 . . . . 73.22 109.868 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 81.3 tttt 72.53 29.8 2.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.833 1.253 . . . . 61.23 109.831 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.08 146.81 35.01 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.725 -1.125 . . . . 72.12 109.123 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 517' ' ' TYR . 9.0 p30 -87.28 137.28 32.47 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 120.525 -0.47 . . . . 43.5 111.171 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.5 ttt -125.42 91.65 3.46 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.511 -1.292 . . . . 74.04 107.511 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.6 -86.75 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.764 -1.107 . . . . 74.21 112.505 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.37 -27.16 13.61 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 113.424 0.898 . . . . 63.53 113.424 -172.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -130.6 157.84 41.63 Favored 'General case' 0 C--N 1.274 -2.69 0 CA-C-N 115.854 -0.612 . . . . 72.24 110.836 -167.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 512' ' ' ASN . 97.6 m-85 -95.56 125.85 40.44 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.152 -0.684 . . . . 75.51 109.152 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 66.7 t -106.92 117.24 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.543 0 CA-C-N 114.994 -1.003 . . . . 74.33 109.764 -175.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -81.7 110.6 17.19 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 107.125 -1.435 . . . . 52.14 107.125 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 520' ' ' VAL . . . . . 0.552 HG22 HD22 ' A' ' 449' ' ' LEU . 75.4 t -103.57 107.65 22.7 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 107.388 -1.338 . . . . 71.24 107.388 177.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -116.43 144.25 44.54 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.965 -0.754 . . . . 63.2 108.965 -175.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' GLN . . . . . 0.412 ' HG3' ' HA ' ' A' ' 502' ' ' PHE . 0.2 OUTLIER -89.04 123.8 33.68 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.769 -1.197 . . . . 55.1 107.769 -175.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 88.7 m -132.37 174.07 10.63 Favored 'General case' 0 C--N 1.283 -2.31 0 N-CA-C 113.434 0.902 . . . . 64.22 113.434 -169.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.579 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.0 t -103.6 154.09 19.88 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.096 -0.956 . . . . 72.53 111.779 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -69.49 -17.26 63.59 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.285 -0.871 . . . . 72.41 109.853 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.42 -46.28 33.68 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.875 -0.602 . . . . 72.31 109.725 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 527' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 524' ' ' SER . 13.5 pt-20 -71.57 -28.64 63.98 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.867 -0.79 . . . . 74.43 108.867 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 528' ' ' MET . . . . . 0.578 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.4 ttt -59.27 -51.64 69.07 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.392 -0.822 . . . . 75.24 109.213 174.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.92 -35.92 82.26 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.435 -0.802 . . . . 70.31 110.144 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.98 -47.79 83.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.533 -0.758 . . . . 71.43 110.583 175.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.15 -35.72 72.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.46 -0.336 . . . . 71.41 110.889 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 532' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 528' ' ' MET . 77.4 mt -67.89 -38.1 82.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.165 0.507 . . . . 73.43 110.018 178.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 48.2 ttm -70.41 -14.43 62.55 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.152 0.977 . . . . 54.23 110.803 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 70.64 36.97 67.73 Favored Glycine 0 C--N 1.282 -2.455 0 CA-C-N 114.313 -1.312 . . . . 75.21 110.579 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -57.67 135.07 52.09 Favored Glycine 0 N--CA 1.416 -2.692 0 O-C-N 124.479 0.752 . . . . 44.24 111.408 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 10.0 t -72.9 123.82 24.2 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-O 121.826 0.822 . . . . 65.32 110.877 -177.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 5.7 tt -127.76 94.34 3.93 Favored 'General case' 0 C--N 1.278 -2.524 0 N-CA-C 105.562 -2.014 . . . . 72.43 105.562 177.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -120.27 95.81 4.89 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-O 122.218 1.009 . . . . 71.34 108.566 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -87.97 107.3 18.65 Favored 'General case' 0 N--CA 1.426 -1.663 0 CA-C-N 114.803 -1.09 . . . . 50.21 108.922 -177.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.437 ' O ' HD22 ' A' ' 540' ' ' LEU . 0.0 OUTLIER -67.32 115.19 6.7 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.81 0.814 . . . . 61.31 110.552 178.098 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 . . . . . 0 N--CA 1.426 -1.642 0 N-CA-C 107.592 -1.262 . . . . 74.13 107.592 -178.553 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 88.6 mtp . . . . . 0 CA--C 1.508 -0.65 0 N-CA-C 108.041 -1.096 . . . . 75.32 108.041 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.09 144.6 89.61 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.909 2.406 . . . . 71.33 113.021 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.36 -8.33 17.29 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.918 2.412 . . . . 73.42 112.021 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 23.4 p -86.94 -177.27 6.02 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 123.595 0.758 . . . . 72.34 109.211 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -68.08 112.29 4.96 Favored 'General case' 0 CA--C 1.5 -0.966 0 C-N-CA 120.149 -0.62 . . . . 44.3 110.117 175.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.6 t -61.18 148.86 8.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 124.426 1.09 . . . . 74.41 110.894 -178.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.599 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 8.0 ptp180 -83.89 65.35 8.58 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 122.024 0.916 . . . . 72.31 112.062 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -103.34 6.23 37.77 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.118 -0.946 . . . . 75.14 111.225 -178.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 38.4 m -107.91 155.08 20.69 Favored 'General case' 0 N--CA 1.415 -2.185 0 N-CA-C 108.852 -0.795 . . . . 52.14 108.852 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -132.57 141.18 45.8 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.379 0 N-CA-C 106.99 -1.485 . . . . 73.35 106.99 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 448' ' ' ARG . . . . . 0.467 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.5 ttp180 -116.24 123.61 48.15 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.863 -0.792 . . . . 74.24 108.863 173.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.458 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 1.6 mt -97.5 135.14 39.78 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 105.82 -1.919 . . . . 75.43 105.82 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -136.39 135.0 38.41 Favored 'General case' 0 C--N 1.287 -2.126 0 C-N-CA 119.771 -0.772 . . . . 50.33 110.889 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 107.11 23.97 6.78 Favored Glycine 0 N--CA 1.432 -1.627 0 N-CA-C 110.399 -1.081 . . . . 52.01 110.399 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.72 144.61 97.88 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 112.965 0.728 . . . . 73.03 112.965 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -55.19 149.54 44.25 Favored 'Trans proline' 0 CA--C 1.492 -1.591 0 C-N-CA 123.107 2.538 . . . . 63.01 112.182 175.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -77.34 106.63 9.21 Favored 'General case' 1 N--CA 1.37 -4.465 0 N-CA-C 106.123 -1.806 . . . . 63.24 106.123 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 92.52 31.19 0.01 OUTLIER 'General case' 0 C--N 1.282 -2.343 0 CA-C-N 111.299 -2.682 . . . . 62.43 112.469 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.7 117.32 12.07 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.269 -1.382 . . . . 75.43 107.269 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.0 p -88.25 173.94 8.49 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.063 0.459 . . . . 65.31 111.722 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.505 ' HA ' HG22 ' A' ' 461' ' ' ILE . 2.5 pp -64.02 -18.55 22.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.55 0.69 . . . . 72.11 111.881 175.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -79.85 -40.43 28.45 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 109.221 -0.659 . . . . 72.22 109.221 175.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.3 -43.58 94.28 Favored 'General case' 0 CA--C 1.497 -1.069 0 CA-C-N 115.859 -0.61 . . . . 53.01 110.731 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.505 HG22 ' HA ' ' A' ' 458' ' ' ILE . 15.9 tt -68.93 -32.83 56.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.572 -0.74 . . . . 74.25 111.173 -176.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.448 HD23 ' O ' ' A' ' 458' ' ' ILE . 3.9 mm? -74.54 -36.3 63.14 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.79 0.328 . . . . 64.21 110.679 176.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.13 -47.97 82.19 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 108.789 -0.819 . . . . 74.12 108.789 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -52.56 -42.06 64.11 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 113.461 -1.699 . . . . 73.11 111.37 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 465' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 493' ' ' ILE . 83.0 mt -63.63 -37.17 86.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.924 -0.58 . . . . 60.22 112.391 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.36 -130.33 18.4 Favored Glycine 0 CA--C 1.484 -1.844 0 C-N-CA 119.773 -1.203 . . . . 62.42 111.765 -177.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.92 -26.67 66.12 Favored 'General case' 0 C--N 1.274 -2.689 0 C-N-CA 124.463 1.105 . . . . 74.52 112.093 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -71.38 -11.73 61.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 73.43 111.511 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.36 -15.54 62.87 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.16 -0.473 . . . . 51.01 111.48 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.2 m -78.2 -28.05 47.95 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-O 121.099 0.476 . . . . 74.15 110.253 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -100.46 10.8 40.7 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.623 0.725 . . . . 74.11 111.507 -172.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 13.4 tt -67.94 142.92 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 N-CA-C 109.504 -0.554 . . . . 74.24 109.504 178.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 495' ' ' MET . 1.6 tpt180 -66.67 155.8 36.98 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.898 -1.149 . . . . 53.33 107.898 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 86.9 m -64.46 106.66 1.18 Allowed 'General case' 0 C--N 1.296 -1.744 0 O-C-N 123.403 0.439 . . . . 74.43 109.995 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 12.2 m170 64.2 27.78 13.96 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.988 0.915 . . . . 74.45 109.859 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.5 -19.32 70.74 Favored Glycine 0 C--N 1.337 0.621 0 CA-C-N 114.955 -1.021 . . . . 60.14 114.055 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.4 p -76.2 118.88 23.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-O 121.455 0.645 . . . . 63.51 110.403 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -134.07 111.49 10.4 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.809 -0.811 . . . . 74.21 108.809 -178.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 76.4 mtp -88.31 139.57 30.35 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.727 -0.789 . . . . 73.23 109.311 179.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.0 t -83.71 100.96 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 108.27 -1.011 . . . . 73.21 108.27 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.45 146.82 23.84 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.69 -1.226 . . . . 75.21 107.69 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -89.17 -172.97 3.86 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 108.304 -0.999 . . . . 64.4 108.304 -176.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -63.61 -26.83 68.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.104 0.478 . . . . 61.53 111.048 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -74.87 -7.21 52.82 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-O 121.482 0.658 . . . . 73.15 110.763 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.0 30.9 62.55 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.793 -0.523 . . . . 71.24 111.793 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -131.06 150.75 77.46 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 106.993 -1.484 . . . . 73.11 106.993 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.42 125.04 17.56 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 122.968 2.445 . . . . 53.45 114.2 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 38.4 m -69.31 -28.62 66.42 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.276 -0.875 . . . . 70.42 110.246 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 133.41 -21.07 4.1 Favored Glycine 0 CA--C 1.493 -1.307 0 CA-C-N 115.59 -0.732 . . . . 52.44 111.526 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 490' ' ' ASP . . . . . 0.458 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 20.3 p-10 -110.72 151.87 27.23 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.336 0.589 . . . . 64.22 111.302 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.77 155.27 36.86 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.662 -0.866 . . . . 64.22 108.662 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 492' ' ' PHE . . . . . 0.467 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 77.6 m-85 -111.48 142.11 44.18 Favored 'General case' 0 C--N 1.284 -2.255 0 CA-C-O 121.063 0.459 . . . . 73.53 110.456 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 493' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 465' ' ' LEU . 67.8 mt -126.8 139.72 51.02 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 105.399 -2.074 . . . . 62.45 105.399 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -121.16 136.16 55.03 Favored 'General case' 0 C--N 1.274 -2.715 0 C-N-CA 119.905 -0.718 . . . . 64.4 109.443 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.402 ' O ' ' HD3' ' A' ' 473' ' ' ARG . 0.2 OUTLIER -103.9 173.7 6.19 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 123.686 0.616 . . . . 72.04 110.242 176.401 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -70.26 -42.08 72.62 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-O 121.197 0.522 . . . . 73.22 110.103 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 497' ' ' SER . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 500' ' ' ARG . 36.6 t -130.38 156.82 44.08 Favored 'General case' 0 N--CA 1.412 -2.331 0 CA-C-N 115.587 -0.733 . . . . 61.15 111.141 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.45 -28.36 66.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.79 -1.095 . . . . 75.42 111.262 -177.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.21 -47.82 84.35 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 116.185 -0.461 . . . . 75.54 111.434 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 500' ' ' ARG . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 497' ' ' SER . 0.5 OUTLIER -74.18 -32.75 63.2 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.031 -0.668 . . . . 74.12 111.076 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.34 96.34 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 123.447 0.467 . . . . 73.54 110.352 177.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -65.65 -42.6 91.24 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.869 -0.605 . . . . 74.31 110.038 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 16.0 tpt -67.91 -37.62 81.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.01 -0.541 . . . . 65.42 110.508 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.62 92.8 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.322 -0.399 . . . . 73.05 109.98 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.84 -38.71 86.93 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-O 120.72 0.295 . . . . 72.2 111.022 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -67.32 -41.38 85.38 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.831 0.348 . . . . 60.25 110.583 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -68.38 -39.59 81.69 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.869 -0.605 . . . . 54.04 110.79 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 508' ' ' CYS . . . . . 0.6 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 49.1 m -99.35 14.22 30.45 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 113.187 0.81 . . . . 71.13 113.187 -175.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -64.83 105.01 0.92 Allowed 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.013 -0.736 . . . . 64.34 109.013 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt 69.9 20.5 6.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.613 1.165 . . . . 61.53 111.648 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 511' ' ' LYS . . . . . 0.6 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 26.5 tptp -70.83 142.17 51.29 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 124.073 0.949 . . . . 71.3 109.076 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -97.97 143.28 28.71 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 119.319 -0.952 . . . . 62.11 110.848 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 44.3 ttm -111.16 114.32 27.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 104.544 -2.391 . . . . 72.13 104.544 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 97.4 mttt 67.16 -85.42 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.344 1.027 . . . . 64.41 109.011 -172.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -137.73 -8.89 1.63 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.466 0.65 . . . . 75.44 111.043 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -92.3 135.17 34.24 Favored 'General case' 0 CA--C 1.485 -1.524 0 N-CA-C 109.0 -0.741 . . . . 74.4 109.0 -175.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -87.01 132.25 33.85 Favored 'General case' 0 C--N 1.259 -3.335 0 CA-C-N 115.586 -0.734 . . . . 74.32 109.678 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 57.6 t -122.43 127.3 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 N-CA-C 108.727 -0.842 . . . . 70.52 108.727 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -93.68 115.6 28.06 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.742 -1.207 . . . . 73.34 107.742 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 520' ' ' VAL . . . . . 0.422 HG22 HD22 ' A' ' 449' ' ' LEU . 94.3 t -104.34 127.06 58.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 CA-C-N 116.392 -0.367 . . . . 62.02 110.93 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -131.53 150.91 51.98 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.008 -0.542 . . . . 75.33 110.766 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -82.7 156.63 23.69 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.168 0.587 . . . . 62.05 110.098 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 66.0 m -157.23 166.56 32.82 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 122.966 0.506 . . . . 74.14 110.163 -176.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 58.5 p -97.06 155.28 16.87 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.916 -0.584 . . . . 65.31 110.32 177.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.45 62.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.127 -0.488 . . . . 53.12 111.688 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.99 -45.91 66.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.575 -0.528 . . . . 74.55 109.575 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.06 -41.7 97.26 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.418 0.628 . . . . 74.13 109.58 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -60.39 -44.41 95.69 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.788 -1.096 . . . . 73.31 110.81 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.13 -40.74 78.09 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.657 -0.498 . . . . 71.0 109.657 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.3 -41.94 97.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.903 -0.59 . . . . 72.12 110.986 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 96.0 t -72.6 -35.85 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 120.71 -0.396 . . . . 74.35 110.766 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 78.6 mt -76.29 -19.37 58.34 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.302 0.573 . . . . 71.34 111.399 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 3.9 tpt -82.71 -8.8 59.57 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 122.308 1.051 . . . . 53.52 109.018 177.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 69.49 28.92 71.86 Favored Glycine 0 C--N 1.297 -1.628 0 CA-C-N 114.022 -1.445 . . . . 55.44 111.241 -177.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -77.96 142.87 26.99 Favored Glycine 0 N--CA 1.396 -3.983 0 N-CA-C 111.545 -0.622 . . . . 45.1 111.545 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 77.9 m -147.61 137.84 23.03 Favored 'General case' 0 C--N 1.289 -2.049 0 N-CA-C 108.03 -1.1 . . . . 70.4 108.03 176.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 56.6 tp -110.05 123.9 50.51 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 116.161 -0.472 . . . . 73.13 109.937 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -78.91 109.23 13.0 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.1 -0.5 . . . . 61.1 109.998 176.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -140.26 95.46 2.89 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.936 -0.764 . . . . 75.4 108.936 176.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 51.5 tp -86.37 89.37 7.85 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.054 -1.461 . . . . 72.44 107.054 177.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 . . . . . 0 N--CA 1.429 -1.489 0 CA-C-N 115.152 -0.931 . . . . 34.44 108.729 -174.781 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 50.5 ttm . . . . . 0 CA--C 1.503 -0.86 0 N-CA-C 108.82 -0.807 . . . . 74.51 108.82 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -58.99 127.8 25.56 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.169 1.913 . . . . 65.3 109.669 174.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -52.12 113.17 1.07 Allowed 'Trans proline' 0 C--O 1.245 0.826 0 C-N-CA 122.711 2.274 . . . . 74.31 110.859 177.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 29.1 m 66.18 75.16 0.34 Allowed 'General case' 0 N--CA 1.439 -0.977 0 O-C-N 124.513 1.133 . . . . 72.52 110.258 -174.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 34.0 p30 -76.22 143.42 41.03 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.569 -1.196 . . . . 72.43 109.473 177.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 52.5 t -119.43 142.45 34.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 108.674 -0.862 . . . . 63.34 108.674 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.601 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 32.3 mtp180 -93.67 67.82 3.92 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 119.645 -0.822 . . . . 73.1 109.353 178.224 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -99.2 12.54 35.88 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.589 -0.732 . . . . 73.1 110.966 -175.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 27.8 m -117.03 149.5 40.18 Favored 'General case' 0 N--CA 1.412 -2.325 0 N-CA-C 108.646 -0.872 . . . . 63.31 108.646 -178.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 447' ' ' ILE . . . . . 0.723 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.3 mt -126.96 151.03 33.33 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.76 0 N-CA-C 107.056 -1.461 . . . . 53.02 107.056 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -125.36 124.81 42.35 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.808 -1.182 . . . . 73.11 107.808 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 15.2 mt -100.78 142.66 31.94 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 107.117 -1.438 . . . . 73.14 107.117 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -144.3 126.99 16.14 Favored 'General case' 0 C--N 1.284 -2.263 0 CA-C-O 121.849 0.833 . . . . 74.41 110.669 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 108.63 32.75 3.05 Favored Glycine 0 C--N 1.279 -2.637 0 CA-C-N 114.754 -1.112 . . . . 61.43 110.781 -177.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 95.4 mt -59.98 140.93 90.23 Favored Pre-proline 0 C--O 1.241 0.616 0 N-CA-C 112.07 0.396 . . . . 73.14 112.07 -179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 452' ' ' LEU . 27.4 Cg_exo -61.08 170.57 4.75 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.104 2.536 . . . . 63.54 113.874 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.95 93.13 4.38 Favored 'General case' 0 N--CA 1.403 -2.785 0 CA-C-N 113.573 -1.649 . . . . 72.33 109.694 178.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 83.06 28.89 0.09 Allowed 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 113.007 -1.906 . . . . 70.03 112.695 171.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -61.4 132.67 54.25 Favored 'General case' 0 C--O 1.246 0.907 0 N-CA-C 108.686 -0.857 . . . . 65.53 108.686 173.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 73.1 p -95.97 176.52 6.08 Favored 'General case' 0 N--CA 1.418 -2.028 0 CA-C-O 121.695 0.759 . . . . 74.41 112.362 -174.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 31.9 pt -65.02 -26.32 39.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.06 0 CA-C-N 115.071 -0.968 . . . . 74.02 111.536 176.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -76.85 -32.29 57.43 Favored 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 119.473 -0.891 . . . . 74.45 110.19 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.84 -42.35 99.71 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.984 -0.553 . . . . 72.12 110.15 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.402 HG22 ' O ' ' A' ' 458' ' ' ILE . 11.8 tt -69.03 -36.03 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 120.606 -0.437 . . . . 71.45 110.666 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 97.6 mt -67.49 -38.99 85.19 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 120.951 0.405 . . . . 73.23 110.246 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -62.51 -51.3 67.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.464 -0.789 . . . . 63.5 109.327 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 94.4 t80 -55.94 -39.4 71.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 113.912 -1.495 . . . . 75.34 111.42 -178.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 71.5 mt -71.31 -32.78 69.02 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.765 -0.652 . . . . 63.21 112.666 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 73.28 -134.06 19.07 Favored Glycine 0 CA--C 1.48 -2.101 0 C-N-CA 119.252 -1.452 . . . . 51.11 111.244 -178.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -64.55 -21.57 66.73 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-N 114.629 -0.785 . . . . 53.15 111.158 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -67.08 -14.18 62.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.277 0.56 . . . . 74.33 110.535 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 469' ' ' ALA . . . . . 0.429 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -71.27 -14.84 62.36 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.025 -0.534 . . . . 63.22 111.151 177.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 27.7 m -84.17 -23.98 30.37 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-O 121.776 0.798 . . . . 72.01 109.028 176.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -90.92 -11.27 39.62 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.44 -0.8 . . . . 72.34 111.999 -175.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 472' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 469' ' ' ALA . 9.5 tt -77.17 132.92 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 N-CA-C 108.868 -0.79 . . . . 52.53 108.868 176.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 -72.71 159.34 33.97 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.942 -0.392 . . . . 71.1 109.942 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 72.1 m -57.18 113.1 1.58 Allowed 'General case' 0 C--O 1.246 0.92 0 CA-C-O 121.286 0.565 . . . . 75.32 111.761 -174.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 62.82 37.35 12.38 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 114.329 -1.305 . . . . 75.12 108.764 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -70.46 -14.29 71.84 Favored Glycine 0 N--CA 1.436 -1.356 0 CA-C-N 115.062 -0.972 . . . . 62.15 111.707 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 492' ' ' PHE . 4.2 p -83.38 101.85 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.87 0 CA-C-O 122.089 0.947 . . . . 74.31 110.588 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -107.78 101.87 11.13 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.45 -0.944 . . . . 75.45 108.45 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 479' ' ' MET . . . . . 0.511 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 46.5 ttm -80.59 137.09 36.35 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 120.908 0.385 . . . . 51.4 110.95 -177.026 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 59.5 t -90.36 111.46 23.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 CA-C-N 115.682 -0.69 . . . . 44.01 110.529 -177.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 2.2 pp -92.91 156.9 16.65 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.289 -0.868 . . . . 51.44 110.415 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -97.21 -169.03 1.79 Allowed 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.891 -1.522 . . . . 63.02 106.891 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -60.02 -30.17 68.99 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 123.342 0.657 . . . . 70.44 111.49 -178.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -73.63 -17.83 61.11 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.039 0.447 . . . . 73.42 110.891 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 89.77 19.41 47.98 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.481 -0.866 . . . . 71.5 111.884 -177.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.456 ' HD3' ' O ' ' A' ' 487' ' ' PRO . 0.1 OUTLIER -118.85 146.7 40.71 Favored Pre-proline 0 N--CA 1.445 -0.676 0 N-CA-C 107.211 -1.403 . . . . 75.51 107.211 179.252 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 487' ' ' PRO . . . . . 0.511 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 10.2 Cg_endo -53.39 133.2 52.15 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 C-N-CA 123.325 2.684 . . . . 75.34 113.265 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 21.1 m -80.02 0.02 33.54 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.674 0.75 . . . . 74.34 109.509 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 94.02 2.07 64.73 Favored Glycine 0 N--CA 1.426 -1.998 0 N-CA-C 110.411 -1.076 . . . . 53.52 110.411 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 490' ' ' ASP . . . . . 0.503 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 18.0 t70 -114.61 146.19 41.11 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.313 -1.366 . . . . 74.04 107.313 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -160.17 162.59 33.92 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 109.619 -0.512 . . . . 64.41 109.619 -177.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 492' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 87.3 m-85 -115.73 145.87 42.4 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 120.646 0.26 . . . . 71.15 110.558 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.1 mt -118.07 134.88 60.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 105.988 -1.856 . . . . 74.44 105.988 172.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -118.72 109.66 16.35 Favored 'General case' 0 C--N 1.27 -2.861 0 N-CA-C 109.414 -0.587 . . . . 73.12 109.414 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.723 ' SD ' HD11 ' A' ' 447' ' ' ILE . 71.8 mtp -104.11 169.15 8.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.957 -0.565 . . . . 74.35 111.043 -175.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.22 -53.13 60.76 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 123.441 0.697 . . . . 74.0 111.775 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -121.2 146.04 47.2 Favored 'General case' 0 N--CA 1.419 -2.009 0 CA-C-N 115.669 -0.696 . . . . 64.34 112.142 -169.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.96 66.57 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-N 114.949 -1.023 . . . . 72.31 109.997 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -68.17 -46.91 69.45 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 122.103 0.954 . . . . 74.42 109.339 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -68.71 -38.78 80.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 114.02 -1.446 . . . . 75.04 109.274 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.14 -38.32 87.85 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.33 -0.85 . . . . 73.13 110.603 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -64.27 -42.54 96.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.585 -0.524 . . . . 73.43 109.585 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.3 mtp -61.88 -43.41 98.91 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.389 -0.369 . . . . 71.44 110.244 178.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.3 96.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.494 -0.775 . . . . 73.01 110.7 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.11 -30.28 67.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.969 0.414 . . . . 43.32 111.382 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -46.56 64.01 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.866 -0.606 . . . . 64.53 110.247 176.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 507' ' ' LYS . . . . . 0.577 ' HE3' ' HA ' ' A' ' 507' ' ' LYS . 1.4 tpmt? -75.7 -31.99 59.92 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.085 0.469 . . . . 73.41 110.582 -175.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 44.1 m -96.41 9.14 42.2 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 120.967 0.413 . . . . 65.41 111.918 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -63.47 101.85 0.37 Allowed 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.294 -0.632 . . . . 73.12 109.294 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 54.54 66.52 1.21 Allowed 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.532 1.533 . . . . 71.1 110.138 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -97.11 141.89 29.71 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 113.634 -1.621 . . . . 51.02 109.49 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.424 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 4.2 m-20 -92.72 116.53 29.1 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 108.214 -1.032 . . . . 71.41 108.214 175.115 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.0 ttt -103.6 103.91 13.91 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 107.336 -1.357 . . . . 71.23 107.336 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 89.0 mttt 67.57 -77.91 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.372 1.069 . . . . 75.44 109.791 -175.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -135.4 -12.17 2.11 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 123.444 0.697 . . . . 60.22 110.926 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 516' ' ' ARG . . . . . 0.424 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 28.2 tpt180 -88.83 152.75 21.57 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.035 -0.53 . . . . 72.14 109.723 -172.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.82 118.21 36.02 Favored 'General case' 0 C--N 1.291 -1.96 0 N-CA-C 107.356 -1.35 . . . . 72.44 107.356 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 60.0 t -114.5 116.98 54.2 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 109.046 -0.724 . . . . 53.24 109.046 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -95.95 110.87 23.01 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.604 -0.887 . . . . 63.31 108.604 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.51 135.21 44.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-N 115.999 -0.546 . . . . 62.01 111.868 -177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -126.35 162.22 26.02 Favored 'General case' 0 C--O 1.215 -0.728 0 C-N-CA 124.35 1.06 . . . . 72.13 109.19 176.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -100.71 157.61 16.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.815 -0.809 . . . . 73.24 108.815 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -156.68 163.43 39.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-O 121.892 0.853 . . . . 65.22 111.501 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 3.6 m -97.74 158.81 15.3 Favored 'General case' 0 C--N 1.271 -2.839 0 CA-C-N 114.722 -1.126 . . . . 63.51 108.555 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -57.24 -33.88 68.02 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 122.019 0.914 . . . . 72.23 108.869 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.4 -41.34 98.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.375 -1.284 . . . . 64.43 110.29 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 527' ' ' GLU . . . . . 0.434 ' O ' HG23 ' A' ' 531' ' ' VAL . 38.3 mt-10 -69.95 -36.53 75.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.213 -0.448 . . . . 73.45 110.095 178.321 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 46.2 ttm -63.7 -43.7 95.84 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.162 -0.681 . . . . 63.0 109.162 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -61.55 -40.28 94.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.212 -0.904 . . . . 74.14 109.593 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -63.69 -41.3 98.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.994 -0.548 . . . . 63.23 110.643 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 531' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' A' ' 535' ' ' GLY . 98.9 t -65.35 -31.44 53.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.143 0.497 . . . . 63.22 110.499 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt -78.67 -37.6 41.46 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 121.317 0.579 . . . . 73.44 111.126 175.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 23.7 ttt -77.62 -40.41 42.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.948 0.88 . . . . 72.45 113.335 -174.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -118.08 -37.18 0.89 Allowed Glycine 1 C--N 1.25 -4.212 0 CA-C-N 114.383 -1.28 . . . . 71.23 113.023 -175.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 535' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' A' ' 531' ' ' VAL . . . 121.05 -171.24 14.77 Favored Glycine 0 N--CA 1.425 -2.043 0 N-CA-C 110.852 -0.899 . . . . 55.24 110.852 179.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.5 t -79.92 80.73 6.29 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-O 123.609 1.671 . . . . 72.14 109.18 175.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 55.9 tp -116.7 100.5 7.86 Favored 'General case' 0 C--N 1.27 -2.861 0 CA-C-N 112.359 -2.2 . . . . 73.35 110.113 -175.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -108.15 93.37 4.5 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 107.565 -1.272 . . . . 72.34 107.565 174.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -121.85 120.89 35.85 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 115.19 -0.914 . . . . 73.43 109.544 -172.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 28.4 tp -145.23 35.59 1.09 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 123.215 1.483 . . . . 75.31 108.596 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 . . . . . 0 C--N 1.273 -2.729 0 CA-C-N 112.963 -1.926 . . . . 72.43 107.031 179.674 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 25.0 ptt? . . . . . 0 C--O 1.221 -0.439 0 N-CA-C 108.64 -0.874 . . . . 73.44 108.64 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -86.44 111.15 1.0 Allowed 'Trans proline' 0 N--CA 1.439 -1.679 0 C-N-CA 121.504 1.469 . . . . 72.01 111.612 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -82.84 11.91 3.09 Favored 'Trans proline' 0 C--O 1.252 1.192 0 C-N-CA 123.457 2.772 . . . . 54.01 110.912 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.4 m -70.31 173.45 6.78 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 126.458 1.903 . . . . 73.51 108.43 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -69.81 87.73 0.53 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.624 0.725 . . . . 62.32 110.171 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.5 t -123.81 111.06 27.53 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 106.377 -1.712 . . . . 71.5 106.377 174.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.595 ' HA ' ' HA ' ' A' ' 524' ' ' SER 0.258 9.4 ptm85 -92.98 73.95 4.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 114.51 1.3 . . . . 72.23 114.51 -176.265 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.66 9.27 17.8 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.097 -0.956 . . . . 52.45 108.898 177.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 17.2 m -107.53 143.88 35.31 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 115.507 -0.769 . . . . 73.1 108.926 -176.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 447' ' ' ILE . . . . . 0.45 HD11 ' SD ' ' A' ' 495' ' ' MET . 3.2 mt -120.95 148.49 24.17 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.79 0 C-N-CA 123.758 0.823 . . . . 71.33 110.09 -176.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -126.58 122.52 35.3 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 107.254 -1.388 . . . . 74.15 107.254 176.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.595 HD22 HG22 ' A' ' 520' ' ' VAL . 27.5 mt -108.55 153.71 22.98 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.267 -0.642 . . . . 64.43 109.267 -175.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 450' ' ' ARG . . . . . 0.426 ' HD2' ' OE2' ' A' ' 519' ' ' GLU . 32.6 ttm180 -142.15 147.56 36.85 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 107.402 -1.332 . . . . 61.4 107.402 172.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 86.24 34.61 12.08 Favored Glycine 0 C--N 1.306 -1.124 0 C-N-CA 120.304 -0.95 . . . . 61.53 114.045 175.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 86.4 mt -82.3 142.34 47.01 Favored Pre-proline 0 C--N 1.302 -1.476 0 N-CA-C 109.015 -0.735 . . . . 74.42 109.015 174.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.58 163.74 2.56 Favored 'Trans proline' 0 C--O 1.252 1.221 0 C-N-CA 123.126 2.551 . . . . 75.53 112.721 176.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -71.95 93.48 1.36 Allowed 'General case' 0 N--CA 1.412 -2.35 0 CA-C-N 114.538 -1.21 . . . . 74.33 110.094 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 78.66 36.46 0.19 Allowed 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 112.105 -2.316 . . . . 53.33 111.815 171.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -57.51 130.95 48.63 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.924 -1.139 . . . . 62.02 107.924 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.89 164.63 26.35 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-O 120.827 0.346 . . . . 41.55 110.439 -173.694 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.443 ' O ' HG22 ' A' ' 461' ' ' ILE . 61.0 mt -62.44 -35.43 69.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.848 0.832 . . . . 73.4 109.686 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -69.17 -29.96 68.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.762 -0.654 . . . . 61.14 110.512 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.62 -39.15 70.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.431 -0.804 . . . . 74.04 110.657 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.4 tt -74.99 -33.41 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 116.237 -0.438 . . . . 55.14 110.455 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.26 -36.2 79.05 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.236 0.541 . . . . 74.4 110.059 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -61.11 -50.96 71.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.026 -0.988 . . . . 73.43 108.886 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -55.73 -38.85 70.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 113.847 -1.524 . . . . 62.43 111.739 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 87.1 mt -64.42 -35.27 80.36 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.114 -0.494 . . . . 62.14 111.901 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 68.52 -132.65 27.42 Favored Glycine 0 CA--C 1.48 -2.102 0 C-N-CA 119.776 -1.202 . . . . 51.41 112.685 178.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.97 -32.3 45.41 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.131 -1.035 . . . . 73.13 112.242 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -69.34 -14.38 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.083 0.468 . . . . 72.14 111.88 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 469' ' ' ALA . . . . . 0.492 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -69.96 -15.45 63.04 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.016 0.436 . . . . 65.42 110.596 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 21.0 m -77.11 -24.05 51.75 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 122.237 -0.289 . . . . 74.22 111.757 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' ASP . . . . . 0.433 ' OD2' ' HB3' ' A' ' 496' ' ' LYS . 30.6 t70 -106.2 -3.13 21.71 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.946 -0.471 . . . . 72.45 111.728 -178.054 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 472' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 469' ' ' ALA . 10.6 tt -59.84 146.11 10.63 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 CA-C-O 120.928 0.394 . . . . 54.33 110.771 -176.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 473' ' ' ARG . . . . . 0.454 ' NH2' ' HA ' ' A' ' 496' ' ' LYS . 15.2 tpp180 -74.1 139.38 44.56 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 105.773 -1.936 . . . . 73.25 105.773 175.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 21.4 m -72.03 116.42 12.42 Favored 'General case' 0 C--N 1.278 -2.536 0 N-CA-C 109.655 -0.498 . . . . 72.33 109.655 -173.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 9.6 m170 67.19 21.93 9.88 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.789 0.835 . . . . 72.03 111.554 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.79 -6.06 88.81 Favored Glycine 0 N--CA 1.439 -1.12 0 CA-C-N 115.252 -0.886 . . . . 61.3 111.316 177.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.4 p -84.44 119.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 CA-C-O 121.169 0.509 . . . . 60.21 109.921 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -134.69 120.52 19.6 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.05 -0.722 . . . . 72.44 109.05 -178.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 65.8 mtt -97.59 147.75 23.98 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 108.243 -1.021 . . . . 73.42 108.243 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.1 t -94.95 109.46 22.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 CA-C-O 121.602 0.715 . . . . 53.44 110.671 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 487' ' ' PRO . 2.9 mp -98.87 146.49 25.91 Favored 'General case' 0 N--CA 1.427 -1.598 0 N-CA-C 107.545 -1.279 . . . . 64.34 107.545 172.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -90.08 -179.82 5.76 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.826 -1.546 . . . . 71.25 106.826 -175.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.9 -16.35 64.26 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 114.371 1.248 . . . . 64.34 114.371 -173.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -81.61 -10.08 59.52 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.515 0.674 . . . . 70.43 109.484 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.72 32.1 25.2 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.513 -0.767 . . . . 75.23 111.589 -177.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 30.3 mmt180 -119.31 131.87 24.2 Favored Pre-proline 0 C--N 1.309 -1.193 0 N-CA-C 107.959 -1.126 . . . . 74.12 107.959 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 487' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 481' ' ' LEU . 51.4 Cg_exo -57.47 129.76 35.57 Favored 'Trans proline' 0 C--O 1.243 0.76 0 C-N-CA 122.226 1.951 . . . . 74.11 111.205 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 8.0 p -73.95 -28.44 61.5 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.83 0.824 . . . . 72.53 108.982 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 120.72 -15.08 9.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 114.89 -1.05 . . . . 65.22 111.455 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -100.39 161.37 13.64 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 120.932 0.396 . . . . 71.14 110.155 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -159.38 177.56 10.85 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.923 -0.581 . . . . 73.52 109.818 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -135.12 143.03 46.35 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 124.566 1.147 . . . . 71.13 108.657 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 53.7 mt -139.73 135.77 39.17 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 N-CA-C 107.143 -1.429 . . . . 53.54 107.143 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -111.59 138.48 48.07 Favored 'General case' 0 C--N 1.272 -2.785 0 C-N-CA 118.934 -1.106 . . . . 75.02 108.415 175.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.45 ' SD ' HD11 ' A' ' 447' ' ' ILE . 79.0 mtp -104.71 -176.75 3.17 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.724 -0.843 . . . . 61.14 108.724 175.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.454 ' HA ' ' NH2' ' A' ' 473' ' ' ARG . 3.2 ttmp? -88.21 -39.31 14.57 Favored 'General case' 0 C--N 1.281 -2.384 0 CA-C-O 121.338 0.589 . . . . 61.04 109.642 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 15.6 m -114.26 141.67 47.27 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 115.1 -0.954 . . . . 74.22 111.502 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.11 67.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.207 -0.906 . . . . 62.24 109.02 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -67.27 -45.69 75.87 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-N 114.813 -1.085 . . . . 61.2 110.544 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -70.76 -36.19 72.98 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.507 -0.77 . . . . 70.35 110.346 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -61.67 -41.46 97.57 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 123.551 0.532 . . . . 70.14 110.331 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -62.24 -43.69 98.26 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.918 -0.583 . . . . 71.33 110.935 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 89.7 mtp -65.05 -41.24 95.35 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.172 -0.467 . . . . 74.05 110.516 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.81 -42.53 94.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.145 -0.48 . . . . 61.52 110.461 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.05 -38.49 85.92 Favored 'General case' 0 C--O 1.195 -1.807 0 CA-C-N 116.134 -0.484 . . . . 63.22 111.056 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.95 -42.84 72.7 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.476 0.655 . . . . 72.45 110.072 178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -68.29 -34.31 75.93 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.668 -0.696 . . . . 61.41 110.55 -177.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 34.7 m -115.1 19.01 16.0 Favored 'General case' 0 N--CA 1.425 -1.714 0 N-CA-C 112.993 0.738 . . . . 71.51 112.993 -174.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 509' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 34.7 t-80 -69.23 93.51 0.62 Allowed 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.511 -0.743 . . . . 71.24 110.299 176.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.407 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 45.6 tttp 71.0 30.04 2.83 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.399 1.479 . . . . 65.15 109.717 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.08 141.91 40.03 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.25 -1.341 . . . . 61.14 108.919 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -77.63 145.79 36.53 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-O 121.256 0.551 . . . . 65.42 110.797 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -129.77 102.17 6.21 Favored 'General case' 0 C--N 1.288 -2.091 0 N-CA-C 106.35 -1.722 . . . . 54.13 106.35 173.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 66.1 -81.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 124.712 1.205 . . . . 63.45 111.958 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -134.76 -2.37 2.66 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 123.399 0.68 . . . . 64.21 112.07 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -115.02 161.39 18.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 107.784 -1.191 . . . . 73.01 107.784 -176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -113.36 121.43 44.33 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.705 -0.479 . . . . 75.43 109.705 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 59.2 t -99.11 112.76 32.11 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.183 0 O-C-N 124.161 0.913 . . . . 71.45 108.638 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 519' ' ' GLU . . . . . 0.426 ' OE2' ' HD2' ' A' ' 450' ' ' ARG . 49.7 mt-10 -96.29 112.71 24.36 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.146 -1.057 . . . . 71.42 108.146 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 520' ' ' VAL . . . . . 0.595 HG22 HD22 ' A' ' 449' ' ' LEU . 93.6 t -104.38 115.6 46.59 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.24 0 CA-C-N 115.382 -0.827 . . . . 71.21 109.602 -177.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.99 147.94 32.56 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 108.491 -0.929 . . . . 73.31 108.491 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -105.34 153.36 21.74 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.259 -1.015 . . . . 72.13 108.259 -178.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.8 p -162.79 168.77 20.94 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.259 0.552 . . . . 72.35 111.906 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.595 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 69.3 m -91.9 160.14 15.43 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-N 115.359 -0.837 . . . . 62.32 112.444 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -51.73 -36.31 46.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.675 -1.148 . . . . 72.15 111.667 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -64.59 -51.14 64.27 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 108.967 -0.753 . . . . 73.23 108.967 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -39.08 90.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.024 -0.535 . . . . 71.22 111.101 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 528' ' ' MET . . . . . 0.512 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.2 ttt -66.81 -45.15 79.26 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.906 -0.588 . . . . 73.3 110.499 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -71.73 -31.56 66.83 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.806 -0.442 . . . . 75.51 109.806 -176.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -61.31 -47.37 86.24 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 123.899 0.88 . . . . 75.11 110.588 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 48.4 t -70.39 -35.09 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.332 -0.547 . . . . 72.2 109.588 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 532' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.2 mt -64.22 -42.64 96.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.195 -0.457 . . . . 63.52 110.822 178.129 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 22.2 mmt -70.06 -16.17 63.1 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.449 0.643 . . . . 72.22 111.866 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 77.97 44.07 12.77 Favored Glycine 0 C--N 1.273 -2.93 0 CA-C-N 114.702 -1.136 . . . . 72.41 111.19 -178.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -62.62 161.05 32.13 Favored Glycine 0 N--CA 1.427 -1.964 0 N-CA-C 111.404 -0.679 . . . . 50.22 111.404 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.4 m -66.92 110.52 3.37 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.581 0.705 . . . . 70.12 110.14 -176.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -142.42 92.06 2.38 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.087 -0.96 . . . . 72.03 108.902 -177.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -137.91 43.66 2.22 Favored 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 103.736 -2.69 . . . . 75.15 103.736 173.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -68.57 97.9 0.83 Allowed 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 111.749 -2.478 . . . . 61.42 112.485 -171.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.83 89.15 2.99 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 103.435 -2.802 . . . . 74.43 103.435 172.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 . . . . . 0 C--N 1.291 -1.949 0 N-CA-C 107.256 -1.387 . . . . 73.21 107.256 -171.633 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 CA--C 1.505 -0.763 0 N-CA-C 108.511 -0.922 . . . . 52.33 108.511 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 439' ' ' PRO . . . . . 0.461 ' HB2' ' O ' ' A' ' 441' ' ' THR . 59.0 Cg_endo -76.6 132.41 13.33 Favored 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 121.897 1.732 . . . . 74.55 110.802 177.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -61.32 -41.86 38.76 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.143 1.895 . . . . 71.11 110.592 177.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' A' ' 439' ' ' PRO . 9.4 m -99.21 131.6 45.13 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 106.201 -1.777 . . . . 53.31 106.201 173.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -70.56 168.46 16.29 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 112.732 0.642 . . . . 73.42 112.732 -174.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.3 t -68.33 142.17 16.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 114.979 -1.009 . . . . 71.4 109.537 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.54 ' HG3' ' OG ' ' A' ' 524' ' ' SER . 7.6 mpt_? -102.28 67.02 1.02 Allowed 'General case' 0 C--O 1.209 -1.059 0 N-CA-C 110.026 -0.361 . . . . 73.14 110.026 -176.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -124.82 14.87 8.63 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 112.592 0.59 . . . . 63.11 112.592 -176.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 20.4 m -108.84 151.64 25.98 Favored 'General case' 0 N--CA 1.413 -2.284 0 N-CA-C 108.462 -0.94 . . . . 21.42 108.462 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.81 132.55 69.96 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.722 0 N-CA-C 108.655 -0.868 . . . . 71.32 108.655 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -106.02 121.41 44.07 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 108.356 -0.979 . . . . 75.12 108.356 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.437 HD22 HG22 ' A' ' 520' ' ' VAL . 18.3 mt -104.45 150.44 24.56 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.684 -1.228 . . . . 72.2 107.684 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 450' ' ' ARG . . . . . 0.412 HH21 ' CD ' ' A' ' 519' ' ' GLU . 60.6 ttp180 -146.52 131.63 18.32 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.853 -0.425 . . . . 73.03 109.853 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.32 41.06 2.12 Favored Glycine 0 C--N 1.289 -2.036 0 CA-C-N 115.737 -0.665 . . . . 65.54 111.653 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.06 130.85 89.38 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.16 . . . . 64.05 111.388 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.506 ' HB2' ' HB2' ' A' ' 456' ' ' ALA . 37.6 Cg_exo -58.91 156.83 31.39 Favored 'Trans proline' 0 N--CA 1.447 -1.216 0 C-N-CA 122.808 2.339 . . . . 74.32 112.67 176.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -78.14 93.11 4.5 Favored 'General case' 0 N--CA 1.408 -2.537 0 CA-C-N 114.103 -1.408 . . . . 74.31 110.006 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.83 25.76 0.03 OUTLIER 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 112.732 -2.031 . . . . 72.41 113.325 172.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 456' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 453' ' ' PRO . . . -69.39 135.87 50.9 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.375 -1.342 . . . . 72.15 107.375 172.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.2 p -89.26 174.7 7.69 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-O 120.884 0.373 . . . . 73.43 111.795 -175.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.454 ' HA ' HG22 ' A' ' 461' ' ' ILE . 72.8 mt -61.48 -38.05 79.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 N-CA-C 108.886 -0.783 . . . . 71.52 108.886 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -64.73 -37.3 87.14 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.403 -0.817 . . . . 72.32 110.714 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -68.75 -43.4 75.92 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.061 0.458 . . . . 60.3 110.437 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 465' ' ' LEU . 12.6 tt -71.85 -33.0 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 CA-C-N 115.839 -0.619 . . . . 53.34 110.621 -175.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.424 ' HG ' ' HB1' ' A' ' 469' ' ' ALA . 8.1 mp -70.8 -30.64 67.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.9 0.381 . . . . 75.52 110.9 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.93 -48.23 66.53 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.207 -1.035 . . . . 61.32 108.207 175.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -54.63 -42.74 71.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.17 -1.377 . . . . 75.33 111.102 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 465' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 90.0 mt -64.95 -31.66 73.01 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.811 -0.631 . . . . 72.22 111.811 178.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 85.83 -149.41 23.28 Favored Glycine 0 N--CA 1.422 -2.268 0 C-N-CA 120.51 -0.852 . . . . 72.51 111.431 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -66.31 -22.52 66.28 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.031 -0.585 . . . . 63.41 111.005 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -62.81 -17.44 61.24 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.808 -0.633 . . . . 74.15 111.101 178.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 469' ' ' ALA . . . . . 0.424 ' HB1' ' HG ' ' A' ' 462' ' ' LEU . . . -67.44 -15.32 63.61 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 116.059 -0.519 . . . . 72.54 110.979 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.3 m -85.83 -3.27 58.87 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.759 0.79 . . . . 65.31 109.508 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' ASP . . . . . 0.439 ' CG ' ' HE ' ' A' ' 500' ' ' ARG . 3.8 m-20 -112.93 13.95 19.65 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.996 -0.547 . . . . 74.32 110.771 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 15.8 tt -72.07 150.63 8.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.282 -0.872 . . . . 72.4 109.017 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -80.34 151.84 29.26 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 109.542 -0.54 . . . . 72.12 109.542 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 1.4 m -59.24 114.41 2.63 Favored 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.881 1.273 . . . . 74.4 109.704 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 59.93 33.21 21.46 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.746 0.818 . . . . 72.55 110.726 -178.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -98.35 37.04 3.64 Favored Glycine 0 N--CA 1.432 -1.584 0 CA-C-N 116.059 -0.519 . . . . 73.13 114.32 -174.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 59.0 t -118.41 111.47 34.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.304 0 N-CA-C 109.016 -0.735 . . . . 71.11 109.016 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 29.9 m-70 -127.65 100.47 5.99 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.243 0.544 . . . . 62.21 111.396 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 479' ' ' MET . . . . . 0.408 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 66.7 mtt -82.61 142.75 31.51 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.907 -0.775 . . . . 71.34 108.907 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 46.9 t -88.01 107.49 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.685 0 N-CA-C 107.214 -1.402 . . . . 62.22 107.214 176.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.8 pp -93.11 158.51 15.74 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.626 -0.715 . . . . 74.44 112.458 -178.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -91.93 173.2 7.97 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 106.342 -1.725 . . . . 75.13 106.342 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -56.05 -27.46 53.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.184 0.447 . . . . 71.44 111.219 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' GLN . . . . . 0.435 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 35.3 tt0 -69.41 -20.23 63.8 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 121.161 0.505 . . . . 72.45 111.345 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 90.87 25.58 24.49 Favored Glycine 0 N--CA 1.435 -1.403 0 CA-C-O 121.463 0.48 . . . . 13.55 112.898 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.435 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 91.3 mtt180 -126.79 144.78 51.2 Favored Pre-proline 0 C--N 1.303 -1.445 0 N-CA-C 108.037 -1.097 . . . . 70.54 108.037 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -53.17 136.18 61.26 Favored 'Trans proline' 0 C--O 1.245 0.868 0 C-N-CA 123.113 2.542 . . . . 75.32 113.055 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.2 m -80.01 1.58 27.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.461 -0.79 . . . . 62.11 111.142 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.85 -30.0 6.57 Favored Glycine 0 CA--C 1.488 -1.656 0 N-CA-C 111.235 -0.746 . . . . 72.03 111.235 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -107.22 152.84 23.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.06 0.457 . . . . 70.41 110.86 179.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.408 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -158.11 169.38 24.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.498 -0.774 . . . . 61.23 109.184 -176.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -127.71 129.88 47.87 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-N 116.182 -0.463 . . . . 60.44 109.775 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 43.3 mt -122.27 133.01 69.85 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.378 0 N-CA-C 105.977 -1.86 . . . . 74.34 105.977 172.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -108.54 136.57 47.92 Favored 'General case' 0 C--N 1.271 -2.812 0 N-CA-C 109.571 -0.529 . . . . 74.52 109.571 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.72 172.59 6.72 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 123.214 0.606 . . . . 62.13 111.442 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -65.07 -43.93 90.58 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.179 0.991 . . . . 75.13 110.181 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 51.0 p -141.03 155.98 46.09 Favored 'General case' 0 N--CA 1.42 -1.943 0 CA-C-N 116.302 -0.408 . . . . 73.5 111.785 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.54 -40.88 93.14 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.02 -0.991 . . . . 72.34 111.392 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.56 -37.84 87.85 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.093 -0.958 . . . . 71.43 111.932 -174.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 500' ' ' ARG . . . . . 0.439 ' HE ' ' CG ' ' A' ' 471' ' ' ASP . 26.0 mmm180 -75.94 -40.77 53.39 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.405 -0.816 . . . . 71.4 109.741 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.34 -41.84 98.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.362 -0.835 . . . . 70.45 111.008 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' PHE . . . . . 0.404 ' HA ' ' HG3' ' A' ' 522' ' ' GLN . 66.1 t80 -64.6 -40.06 94.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.855 -0.611 . . . . 72.5 110.978 -178.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 55.6 ttm -70.32 -37.63 74.76 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.303 -0.559 . . . . 65.11 110.304 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.004 -0.544 . . . . 34.32 110.644 178.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.14 -32.18 70.04 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.076 -0.511 . . . . 74.23 111.836 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -72.89 -34.8 66.91 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.335 0.588 . . . . 55.33 109.772 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -68.69 -41.7 78.81 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.438 -0.801 . . . . 73.44 110.778 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 62.2 m -105.5 20.68 18.48 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 112.558 0.577 . . . . 71.13 112.558 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.89 92.32 0.23 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.384 0.611 . . . . 63.23 110.572 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 82.7 tttt 64.31 62.74 0.81 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.501 1.52 . . . . 74.41 110.041 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -105.82 139.38 40.48 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 113.429 -1.714 . . . . 64.45 107.763 179.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 517' ' ' TYR . 3.2 p-10 -75.78 140.72 42.5 Favored 'General case' 0 C--N 1.293 -1.879 0 CA-C-O 121.216 0.532 . . . . 72.24 111.268 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.7 ttt -126.19 90.68 3.23 Favored 'General case' 0 N--CA 1.415 -2.19 0 N-CA-C 105.576 -2.009 . . . . 75.44 105.576 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp 68.55 -84.86 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.928 -1.487 . . . . 72.44 110.573 -177.045 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -107.35 -35.87 6.67 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 115.966 -0.561 . . . . 74.54 112.082 -177.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.4 ttm105 -108.63 153.1 23.89 Favored 'General case' 0 C--N 1.273 -2.76 0 CA-C-N 114.992 -1.003 . . . . 65.0 109.833 -165.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 517' ' ' TYR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 512' ' ' ASN . 7.6 p90 -101.2 121.29 41.58 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 121.219 0.533 . . . . 70.53 112.083 -177.307 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.55 109.97 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.277 0 CA-C-N 114.887 -1.052 . . . . 53.45 108.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 519' ' ' GLU . . . . . 0.412 ' CD ' HH21 ' A' ' 450' ' ' ARG . 37.2 mt-10 -89.41 110.86 21.63 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 107.808 -1.182 . . . . 64.2 107.808 178.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 520' ' ' VAL . . . . . 0.437 HG22 HD22 ' A' ' 449' ' ' LEU . 85.5 t -104.4 123.43 58.27 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.143 0 CA-C-N 115.874 -0.603 . . . . 73.03 109.501 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -122.07 135.32 54.8 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.006 -0.739 . . . . 65.14 109.006 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 522' ' ' GLN . . . . . 0.404 ' HG3' ' HA ' ' A' ' 502' ' ' PHE . 0.0 OUTLIER -90.85 125.63 35.79 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 106.828 -1.545 . . . . 52.2 106.828 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 62.4 m -134.49 170.31 15.95 Favored 'General case' 0 C--N 1.284 -2.24 0 CA-C-N 115.348 -0.842 . . . . 50.42 111.014 -171.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.54 ' OG ' ' HG3' ' A' ' 444' ' ' ARG . 44.4 m -92.69 164.1 13.52 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 116.278 -0.419 . . . . 50.24 110.721 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.91 -23.05 63.19 Favored 'General case' 0 C--O 1.209 -1.063 0 CA-C-N 115.552 -0.749 . . . . 73.21 111.056 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.55 -50.31 70.0 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.146 -0.479 . . . . 72.4 110.379 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.6 -40.59 95.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.185 0.517 . . . . 70.12 110.607 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 528' ' ' MET . . . . . 0.506 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 27.8 ttt -67.01 -44.43 80.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.631 -0.713 . . . . 70.35 110.417 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.13 -35.95 80.82 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-N 116.12 -0.491 . . . . 71.41 110.164 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -62.73 -46.2 89.17 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.983 -0.553 . . . . 72.31 110.664 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 58.4 t -74.35 -31.79 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 120.327 -0.549 . . . . 73.1 110.911 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 532' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 528' ' ' MET . 73.3 mt -77.28 -27.14 53.0 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.909 0.385 . . . . 74.44 110.869 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 25.4 ttt -73.85 -24.03 59.71 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.762 1.268 . . . . 73.33 108.911 176.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 73.37 -6.03 17.98 Favored Glycine 0 C--N 1.281 -2.521 0 CA-C-N 113.141 -1.845 . . . . 64.25 113.362 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -73.51 136.54 22.28 Favored Glycine 0 N--CA 1.399 -3.78 0 N-CA-C 111.169 -0.772 . . . . 44.22 111.169 -178.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 44.5 m -151.18 133.54 15.4 Favored 'General case' 0 C--N 1.28 -2.451 0 N-CA-C 107.124 -1.436 . . . . 53.41 107.124 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 45.4 tp -124.62 61.98 1.14 Allowed 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.085 0.945 . . . . 71.53 109.107 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -105.49 86.5 2.42 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 107.039 -1.467 . . . . 73.42 107.039 176.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -160.21 111.12 1.89 Allowed 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 107.928 -1.138 . . . . 73.33 107.928 -176.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 8.5 mp -71.76 99.5 2.17 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 123.681 0.613 . . . . 62.43 110.414 -178.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 . . . . . 0 C--N 1.301 -1.504 0 N-CA-C 107.616 -1.253 . . . . 74.43 107.616 -178.899 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 CA--C 1.504 -0.813 0 N-CA-C 108.675 -0.861 . . . . 72.2 108.675 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.81 160.57 43.18 Favored 'Trans proline' 0 C--O 1.245 0.858 0 C-N-CA 122.627 2.218 . . . . 74.15 110.791 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.83 -5.11 15.67 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.159 1.906 . . . . 72.34 111.957 -177.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 39.4 m 73.97 150.12 0.11 Allowed 'General case' 0 C--O 1.242 0.661 0 C-N-CA 124.341 1.057 . . . . 70.31 109.628 -177.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -81.44 78.66 8.18 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.883 0.849 . . . . 64.21 109.215 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.61 155.55 7.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-N 113.792 -1.549 . . . . 72.11 109.522 -176.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 444' ' ' ARG . . . . . 0.522 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 22.1 ptt180 -87.25 51.91 2.36 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 122.545 1.164 . . . . 75.14 109.525 176.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -101.93 9.25 40.72 Favored 'General case' 0 C--N 1.3 -1.543 0 CA-C-N 114.144 -1.389 . . . . 75.23 111.288 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 44.3 m -107.54 149.36 28.09 Favored 'General case' 0 N--CA 1.412 -2.351 0 C-N-CA 119.559 -0.857 . . . . 65.03 109.948 -176.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 447' ' ' ILE . . . . . 0.664 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.5 mt -122.08 141.47 42.36 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.936 0 N-CA-C 106.892 -1.522 . . . . 71.05 106.892 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -116.63 124.94 51.01 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 108.101 -1.074 . . . . 74.14 108.101 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.6 mt -108.88 125.46 52.02 Favored 'General case' 0 C--N 1.279 -2.483 0 N-CA-C 106.038 -1.838 . . . . 70.42 106.038 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -136.52 137.26 40.11 Favored 'General case' 0 C--N 1.274 -2.709 0 CA-C-O 121.32 0.581 . . . . 54.15 110.372 -176.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 95.08 23.0 21.36 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 110.279 -1.128 . . . . 61.54 110.279 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.9 mt -60.11 145.46 85.15 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 123.899 0.88 . . . . 72.41 111.932 -178.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -59.98 158.96 27.3 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 C-N-CA 122.836 2.357 . . . . 61.45 113.707 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -77.17 95.1 4.2 Favored 'General case' 0 N--CA 1.396 -3.161 0 CA-C-N 113.004 -1.907 . . . . 75.34 109.683 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 87.74 26.84 0.04 OUTLIER 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 112.362 -2.199 . . . . 71.33 112.926 171.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -67.55 136.2 54.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.579 -0.737 . . . . 60.02 109.228 173.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 5.8 p -85.68 151.9 23.51 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 115.663 -0.699 . . . . 74.45 109.574 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 458' ' ' ILE . . . . . 0.621 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.253 2.7 pp -62.3 -29.66 47.17 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.763 0 C-N-CA 120.003 -0.679 . . . . 73.34 112.606 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.86 -29.42 67.73 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.884 0.374 . . . . 70.42 111.224 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -75.51 -40.09 57.57 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.929 -0.767 . . . . 60.43 108.929 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 461' ' ' ILE . . . . . 0.443 HG22 ' HA ' ' A' ' 458' ' ' ILE . 12.4 tt -75.07 -28.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 C-N-CA 120.137 -0.625 . . . . 52.23 111.07 -179.069 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 87.0 mt -63.62 -34.84 78.71 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.676 -0.49 . . . . 75.2 109.676 175.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.19 -48.54 70.33 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.341 -0.985 . . . . 72.33 108.341 176.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.74 -41.18 70.09 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 113.992 -1.458 . . . . 72.34 111.2 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 97.0 mt -69.65 -37.39 76.73 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.013 -0.539 . . . . 75.52 110.325 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 87.29 -146.65 20.36 Favored Glycine 0 N--CA 1.418 -2.509 0 C-N-CA 120.758 -0.734 . . . . 63.24 112.97 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -49.75 -30.54 9.66 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 126.343 1.857 . . . . 73.04 113.275 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -61.62 -19.58 62.41 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.38 0.672 . . . . 72.51 112.368 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -61.9 -15.29 41.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.213 0.82 . . . . 72.42 113.213 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 12.8 t -86.58 -15.02 41.16 Favored 'General case' 0 CA--C 1.551 1.012 0 O-C-N 121.694 -0.629 . . . . 53.0 111.548 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' ASP . . . . . 0.403 ' HB3' ' CE ' ' A' ' 495' ' ' MET . 36.9 t70 -102.42 13.44 34.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.167 0.984 . . . . 51.3 110.469 -174.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 11.2 tt -73.53 152.62 7.31 Favored 'Isoleucine or valine' 0 C--O 1.248 1.013 0 CA-C-N 115.195 -0.911 . . . . 72.33 109.202 177.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -83.87 144.59 29.13 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 119.836 -0.745 . . . . 64.22 109.126 173.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 20.4 m -59.9 119.31 7.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.783 -0.821 . . . . 72.24 108.783 176.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 36.2 t-80 68.11 21.55 8.65 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.305 1.05 . . . . 64.24 109.257 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.75 -15.99 80.5 Favored Glycine 0 N--CA 1.438 -1.176 0 CA-C-N 115.512 -0.767 . . . . 63.0 112.296 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -83.67 123.81 39.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.445 0.641 . . . . 62.43 110.404 178.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -133.24 117.12 17.02 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.674 -0.861 . . . . 74.11 108.674 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.0 mtt -91.87 145.5 24.5 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-O 120.676 0.274 . . . . 64.23 110.341 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.9 t -84.61 96.33 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.545 0 N-CA-C 105.74 -1.948 . . . . 74.5 105.74 172.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.3 pp -96.03 161.42 13.99 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 114.209 -1.36 . . . . 71.32 113.356 -176.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.02 162.98 16.52 Favored 'General case' 0 C--N 1.282 -2.336 0 N-CA-C 104.098 -2.556 . . . . 71.24 104.098 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 64.3 m80 -70.31 -5.16 25.92 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 119.788 1.176 . . . . 72.25 112.411 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -83.39 -7.02 59.63 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.073 -0.967 . . . . 75.31 109.143 172.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 81.29 29.15 41.68 Favored Glycine 0 CA--C 1.495 -1.218 0 CA-C-N 115.746 -0.661 . . . . 55.44 112.859 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -117.43 127.41 26.69 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 108.669 -0.863 . . . . 61.32 108.669 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.78 126.63 19.39 Favored 'Trans proline' 0 C--O 1.243 0.772 0 C-N-CA 122.347 2.032 . . . . 52.23 111.197 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.6 m -74.95 -2.14 25.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.892 -0.594 . . . . 71.4 112.068 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 107.56 10.93 26.19 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.88 -0.676 . . . . 54.43 111.737 179.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -132.25 138.31 47.86 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.168 -1.419 . . . . 63.15 107.168 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.17 161.37 30.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.868 0.366 . . . . 45.11 110.73 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -122.9 142.81 50.39 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 123.3 0.64 . . . . 72.24 109.3 177.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 60.8 mt -128.62 126.5 65.37 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.228 0 N-CA-C 107.491 -1.299 . . . . 53.43 107.491 174.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -100.19 126.36 46.46 Favored 'General case' 0 C--N 1.275 -2.648 0 N-CA-C 109.539 -0.541 . . . . 51.31 109.539 177.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 495' ' ' MET . . . . . 0.664 ' SD ' HD11 ' A' ' 447' ' ' ILE . 82.9 mtp -100.47 170.38 8.43 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 108.364 -0.976 . . . . 74.44 108.364 177.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -80.82 -35.59 32.72 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.4 -0.592 . . . . 72.43 109.4 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.5 m -122.06 141.36 51.46 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-O 121.469 0.652 . . . . 73.13 111.205 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -76.18 -22.71 55.0 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.9 . . . . 71.44 111.84 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -70.97 -40.93 71.64 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.782 -0.644 . . . . 73.25 110.753 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -38.41 67.2 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.279 -0.873 . . . . 75.0 111.753 173.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 501' ' ' ALA . . . . . 0.418 ' HA ' ' SD ' ' A' ' 495' ' ' MET . . . -57.81 -44.73 86.54 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.196 0.522 . . . . 53.52 110.779 178.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -63.13 -39.2 94.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.631 -0.713 . . . . 70.21 110.426 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.85 -34.99 72.21 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.64 0.237 . . . . 75.04 111.64 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.15 -43.24 82.83 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.56 -0.533 . . . . 64.14 109.56 177.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -66.45 -29.67 69.85 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.897 -0.592 . . . . 74.23 110.901 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -71.52 -44.69 64.17 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.458 -0.571 . . . . 63.3 109.458 177.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.2 -44.51 96.42 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.611 -0.722 . . . . 73.44 110.347 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 58.9 m -98.71 10.44 41.14 Favored 'General case' 0 N--CA 1.421 -1.907 0 N-CA-C 113.513 0.931 . . . . 34.12 113.513 -173.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 509' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 32.7 t60 -77.06 104.35 7.5 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 119.439 -0.904 . . . . 73.23 109.453 174.097 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 73.01 19.43 3.7 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.72 1.208 . . . . 74.43 110.617 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.02 146.67 26.55 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.502 -1.296 . . . . 70.01 107.502 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -98.04 149.52 22.38 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 118.666 -1.214 . . . . 75.2 111.673 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.0 ttt -120.17 113.0 19.79 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 104.946 -2.242 . . . . 52.33 104.946 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.3 mttm 69.99 -87.19 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.118 -1.067 . . . . 72.33 108.118 -172.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.25 1.53 1.24 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.314 0.646 . . . . 74.41 111.417 175.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -103.99 142.58 34.19 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 107.566 -1.272 . . . . 71.22 107.566 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -95.24 125.35 39.82 Favored 'General case' 0 C--N 1.265 -3.077 0 CA-C-O 121.489 0.661 . . . . 73.31 110.7 -176.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 61.4 t -102.23 127.39 55.84 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.666 0 N-CA-C 106.881 -1.525 . . . . 72.2 106.881 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -103.77 109.21 20.84 Favored 'General case' 0 N--CA 1.411 -2.404 0 N-CA-C 108.221 -1.029 . . . . 75.44 108.221 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.0 t -106.73 134.28 48.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 CA-C-N 115.15 -0.932 . . . . 61.43 110.623 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -125.33 159.9 30.63 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.437 -0.949 . . . . 73.53 108.437 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 522' ' ' GLN . . . . . 0.515 ' OE1' ' HB2' ' A' ' 444' ' ' ARG . 0.7 OUTLIER -101.68 139.49 37.25 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.392 -1.336 . . . . 40.1 107.392 177.482 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 65.1 m -141.01 169.47 17.54 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.86 0.362 . . . . 62.41 110.724 -175.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.3 p -99.2 159.96 14.61 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.999 -0.546 . . . . 62.43 109.931 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -56.99 -30.88 64.52 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 123.614 0.571 . . . . 63.41 109.646 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.36 -52.56 57.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.377 1.071 . . . . 55.04 110.068 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -59.68 -42.81 93.75 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.675 0.75 . . . . 73.34 109.076 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 22.1 ttt -62.01 -45.04 95.33 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 114.586 -1.188 . . . . 74.52 110.199 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.99 -39.3 87.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.938 -0.573 . . . . 65.42 109.761 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -68.31 -39.12 82.12 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.079 -0.509 . . . . 71.34 110.764 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 91.5 t -73.3 -38.11 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 C-N-CA 120.233 -0.587 . . . . 63.13 110.469 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 92.3 mt -75.15 -19.3 59.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.204 0.526 . . . . 70.23 111.772 -178.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 27.8 ttt -86.05 -4.08 59.09 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.669 0.747 . . . . 75.54 110.442 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 66.22 40.69 94.92 Favored Glycine 0 C--N 1.305 -1.171 0 N-CA-C 110.139 -1.184 . . . . 23.24 110.139 -176.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -58.33 121.7 27.17 Favored Glycine 0 N--CA 1.411 -2.976 0 CA-C-N 114.556 -0.822 . . . . 60.42 114.175 -175.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 21.3 m -104.75 134.43 47.92 Favored 'General case' 0 C--N 1.269 -2.9 0 N-CA-C 105.797 -1.927 . . . . 72.04 105.797 175.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 4.3 tt -83.61 81.44 8.74 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 108.188 -1.042 . . . . 71.5 108.188 -177.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -108.5 83.59 1.8 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.733 -1.121 . . . . 74.32 108.218 178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -139.31 41.01 2.08 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.912 -1.514 . . . . 63.13 106.912 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.9 tt -86.5 121.84 29.61 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 113.331 -1.759 . . . . 70.1 108.378 -174.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 . . . . . 0 C--N 1.286 -2.195 0 N-CA-C 107.207 -1.405 . . . . 60.23 107.207 179.699 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 30.3 t . . . . . 0 N--CA 1.439 -1.007 0 N-CA-C 107.401 -1.333 . . . . 55.329999999999998 107.401 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.563 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 59.0 mtp85 -90.06 62.25 5.49 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 121.851 0.834 . . . . 74.510000000000005 109.813 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.2 p30 -111.43 11.73 21.46 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-N 115.005 -0.998 . . . . 71.409999999999997 110.168 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 494' ' ' GLN . 28.3 m -109.07 151.28 26.6 Favored 'General case' 0 N--CA 1.408 -2.539 0 N-CA-C 107.797 -1.186 . . . . 64.319999999999993 107.797 -177.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . 0.441 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.2 mt -132.13 143.9 38.7 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.39 0 N-CA-C 108.354 -0.98 . . . . 64.010000000000005 108.354 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -112.29 119.1 37.16 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 108.056 -1.09 . . . . 64.129999999999995 108.056 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 10.6 mt -94.42 141.5 28.51 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.505 -2.035 . . . . 71.129999999999995 105.505 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . 0.47 ' HE ' ' CG ' ' A' ' 490' ' ' ASP . 0.0 OUTLIER -142.65 135.83 28.48 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 119.53 -0.868 . . . . 75.019999999999996 109.861 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 450' ' ' ARG . . . 99.51 22.26 13.03 Favored Glycine 0 C--N 1.28 -2.576 0 CA-C-N 114.474 -1.239 . . . . 74.120000000000005 112.188 177.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.75 144.59 96.35 Favored Pre-proline 0 C--O 1.242 0.66 0 C-N-CA 122.883 0.473 . . . . 70.409999999999997 111.974 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -57.21 160.65 12.73 Favored 'Trans proline' 0 C--O 1.252 1.218 0 C-N-CA 123.395 2.73 . . . . 64.010000000000005 113.762 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -77.19 98.61 5.15 Favored 'General case' 0 N--CA 1.401 -2.903 0 CA-C-N 113.952 -1.476 . . . . 70.340000000000003 108.686 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.96 30.43 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.485 0 CA-C-N 111.966 -2.379 . . . . 65.510000000000005 111.971 172.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -54.2 121.87 9.09 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 108.425 -0.954 . . . . 62.340000000000003 108.425 171.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 7.2 p -81.02 169.35 17.61 Favored 'General case' 0 N--CA 1.414 -2.27 0 CA-C-N 115.963 -0.562 . . . . 70.019999999999996 111.952 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.651 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 16.2 tt -67.1 -31.69 54.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 CA-C-N 116.185 -0.461 . . . . 72.120000000000005 111.957 -174.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -80.25 -28.19 38.52 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.74 -0.784 . . . . 73.420000000000002 110.264 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.62 -40.1 80.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.14 -0.936 . . . . 70.109999999999999 108.968 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.5 tt -71.01 -32.88 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 115.41 -0.814 . . . . 75.219999999999999 110.065 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 93.1 mt -68.25 -40.08 82.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.327 -0.249 . . . . 75.549999999999997 110.327 178.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.97 -52.43 64.2 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 121.502 0.667 . . . . 60.219999999999999 109.28 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -53.97 -39.4 65.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.905 -1.498 . . . . 70.420000000000002 111.878 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 94.7 mt -72.64 -36.49 68.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.915 -0.584 . . . . 61.439999999999998 111.92 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.82 -140.41 25.86 Favored Glycine 0 N--CA 1.43 -1.72 0 C-N-CA 119.85 -1.167 . . . . 52.340000000000003 111.855 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.46 -17.85 63.15 Favored 'General case' 0 C--N 1.287 -2.133 0 CA-C-N 114.603 -0.798 . . . . 75.040000000000006 113.017 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -70.6 -22.02 62.59 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.352 0.596 . . . . 75.450000000000003 110.899 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.4 -14.65 62.65 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.453 0.644 . . . . 73.430000000000007 110.521 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 15.9 m -81.68 -18.21 45.31 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 111.222 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -112.97 16.13 19.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.998 0.904 . . . . 74.420000000000002 110.672 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -66.81 145.58 13.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.879 0 CA-C-N 115.761 -0.654 . . . . 73.099999999999994 109.438 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -78.5 155.29 29.88 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.3 -1.37 . . . . 64.140000000000001 107.3 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 12.3 p -54.75 114.22 1.62 Allowed 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 123.426 0.69 . . . . 51.140000000000001 111.382 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 63.11 26.19 15.24 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.69 0.796 . . . . 51.240000000000002 111.968 -176.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.18 70.88 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 116.291 -0.413 . . . . 71.109999999999999 113.596 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.2 p -85.7 114.26 25.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.894 0.854 . . . . 73.120000000000005 112.245 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -124.78 113.76 18.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.079 -0.964 . . . . 73.150000000000006 109.508 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 66.1 mtt -88.94 136.97 32.73 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.924 -0.769 . . . . 74.140000000000001 108.924 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.61 121.12 37.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 N-CA-C 108.93 -0.767 . . . . 73.329999999999998 108.93 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 85.6 mt -92.95 158.7 15.68 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.756 -0.831 . . . . 75.430000000000007 108.756 179.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -106.6 -174.64 2.58 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.78 -1.563 . . . . 74.120000000000005 106.78 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -53.8 -39.96 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.771 0.828 . . . . 70.129999999999995 111.858 -176.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -68.68 -12.7 61.71 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.563 0.745 . . . . 63.439999999999998 111.993 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 84.48 24.21 47.76 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.454 -0.658 . . . . 75.219999999999999 111.454 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -127.86 152.86 77.85 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 106.937 -1.505 . . . . 72.430000000000007 106.937 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -50.55 135.12 40.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.308 2.672 . . . . 62.130000000000003 114.914 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 43.2 t -76.16 -18.75 58.97 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.662 -1.154 . . . . 73.129999999999995 109.11 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 102.09 -2.07 51.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 109.091 -1.603 . . . . 74.140000000000001 109.091 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . 0.47 ' CG ' ' HE ' ' A' ' 450' ' ' ARG . 8.6 m-20 -104.95 143.65 32.87 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 107.545 -1.279 . . . . 72.340000000000003 107.545 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -151.67 148.53 28.05 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 108.737 -0.838 . . . . 61.119999999999997 108.737 175.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . 0.413 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 70.1 m-85 -122.43 127.82 50.12 Favored 'General case' 0 C--N 1.282 -2.367 0 N-CA-C 108.692 -0.855 . . . . 73.349999999999994 108.692 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.6 mt -124.7 128.23 73.26 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 N-CA-C 109.053 -0.721 . . . . 72.239999999999995 109.053 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 446' ' ' CYS . 35.6 tt0 -102.55 123.82 46.98 Favored 'General case' 0 C--N 1.282 -2.363 0 N-CA-C 109.485 -0.561 . . . . 74.319999999999993 109.485 177.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.459 ' HE2' ' HB3' ' A' ' 500' ' ' ARG . 80.4 mtp -96.97 171.63 8.37 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.537 -0.756 . . . . 73.420000000000002 109.092 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -74.69 -38.29 62.43 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 121.284 0.564 . . . . 53.100000000000001 110.074 -177.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . 0.422 ' HB2' ' HD3' ' A' ' 500' ' ' ARG . 1.7 m -115.63 141.12 48.49 Favored 'General case' 0 N--CA 1.403 -2.776 0 CA-C-N 115.432 -0.803 . . . . 71.540000000000006 110.039 -172.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -75.75 -25.04 56.16 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.334 0.587 . . . . 74.239999999999995 110.795 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.6 -40.9 55.74 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.603 -0.726 . . . . 74.299999999999997 109.45 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . 0.459 ' HB3' ' HE2' ' A' ' 495' ' ' MET . 8.7 mpt_? -63.16 -41.48 99.25 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.839 -1.073 . . . . 70.310000000000002 110.647 174.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -59.82 -44.03 94.25 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.503 0.502 . . . . 73.409999999999997 110.685 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 75.430000000000007 110.468 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 4.2 tpt -62.62 -41.62 99.12 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.005 -0.543 . . . . 75.519999999999996 109.845 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.37 -39.9 89.4 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.305 -0.407 . . . . 72.219999999999999 110.927 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.53 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -72.57 -22.87 60.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.345 -0.389 . . . . 64.5 111.912 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -82.57 -44.6 15.66 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 109.024 -0.732 . . . . 71.319999999999993 109.024 176.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.88 -43.24 96.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.722 -1.126 . . . . 71.439999999999998 110.045 -178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 62.8 m -101.6 13.68 34.22 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 115.208 -0.905 . . . . 54.119999999999997 112.985 -175.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . 0.53 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 25.3 t-80 -68.47 92.19 0.43 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.911 -0.774 . . . . 54.420000000000002 108.911 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.474 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 81.1 tttt 67.46 70.46 0.36 Allowed 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.871 1.668 . . . . 75.109999999999999 109.637 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 87.1 tttt -105.21 148.08 27.32 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 113.274 -1.785 . . . . 51.200000000000003 108.363 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -84.3 117.61 23.67 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.85 -0.74 . . . . 73.439999999999998 109.623 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.446 ' SD ' HG21 ' A' ' 518' ' ' VAL . 26.3 ttt -108.37 95.37 5.62 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 106.935 -1.506 . . . . 63.520000000000003 106.935 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt 69.57 -79.39 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.335 1.022 . . . . 73.519999999999996 111.123 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -135.23 -3.65 2.43 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.944 0.878 . . . . 73.019999999999996 110.65 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -109.83 162.1 14.81 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.693 -0.855 . . . . 75.140000000000001 108.693 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -112.62 117.7 33.01 Favored 'General case' 0 N--CA 1.426 -1.653 0 N-CA-C 108.277 -1.009 . . . . 65.420000000000002 108.277 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . 0.446 HG21 ' SD ' ' A' ' 513' ' ' MET . 95.2 t -106.46 122.12 59.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.887 0 CA-C-N 114.901 -1.045 . . . . 73.230000000000004 108.563 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . 0.474 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 39.3 tt0 -99.2 114.35 27.1 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 108.434 -0.95 . . . . 71.209999999999994 108.434 -178.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 92.6 t -104.87 136.09 40.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 CA-C-N 114.998 -1.001 . . . . 62.009999999999998 109.777 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -135.29 141.86 45.76 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.514 -0.921 . . . . 72.010000000000005 108.514 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -76.66 154.69 34.03 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 109.452 -0.573 . . . . 72.329999999999998 109.452 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.8 m -152.36 169.28 22.92 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.291 0.567 . . . . 75.319999999999993 109.535 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 76.4 p -104.35 164.92 11.4 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 108.178 -1.045 . . . . 72.140000000000001 108.178 176.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -54.71 -39.06 67.8 Favored 'General case' 0 C--N 1.307 -1.265 0 O-C-N 123.734 0.646 . . . . 73.439999999999998 110.363 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -62.93 -47.19 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.949 -0.569 . . . . 71.120000000000005 110.567 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -63.21 -37.16 86.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.374 -0.376 . . . . 73.340000000000003 111.446 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . 0.42 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.3 ttt -62.79 -48.37 79.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.923 -0.58 . . . . 51.409999999999997 110.314 177.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -68.36 -34.68 76.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.3 0.571 . . . . 73.140000000000001 109.994 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.29 -41.51 96.84 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.26 -0.882 . . . . 74.129999999999995 110.906 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 62.7 t -75.98 -35.0 28.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 C-N-CA 119.709 -0.796 . . . . 63.009999999999998 110.293 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 528' ' ' MET . 91.4 mt . . . . . 0 C--O 1.241 0.653 0 CA-C-N 116.318 -0.401 . . . . 70.519999999999996 111.483 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.246 0.893 0 N-CA-C 107.692 -1.225 . . . . 75.129999999999995 107.692 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.588 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 63.7 mtm180 -85.12 66.96 10.01 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.822 0.82 . . . . 71.319999999999993 110.735 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -106.41 7.64 31.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.031 -0.986 . . . . 71.129999999999995 111.179 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.477 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 18.4 m -106.24 137.08 44.83 Favored 'General case' 0 N--CA 1.416 -2.142 0 C-N-CA 119.445 -0.902 . . . . 74.340000000000003 108.874 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -115.54 132.57 64.53 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.265 0 N-CA-C 107.557 -1.275 . . . . 55.219999999999999 107.557 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.29 125.56 50.65 Favored 'General case' 0 C--N 1.274 -2.716 0 N-CA-C 108.213 -1.032 . . . . 74.540000000000006 108.213 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 17.7 mt -105.33 143.65 33.21 Favored 'General case' 0 C--N 1.275 -2.646 0 N-CA-C 105.913 -1.884 . . . . 75.510000000000005 105.913 178.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . 0.417 ' HD3' ' OE1' ' A' ' 519' ' ' GLU . 49.2 ttt180 -152.62 141.28 20.9 Favored 'General case' 0 C--N 1.289 -2.023 0 C-N-CA 120.907 -0.317 . . . . 74.120000000000005 110.16 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 85.05 23.6 48.24 Favored Glycine 0 C--N 1.311 -0.827 0 N-CA-C 110.615 -0.994 . . . . 71.140000000000001 110.615 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.08 151.07 67.8 Favored Pre-proline 0 C--O 1.244 0.776 0 C-N-CA 123.974 0.91 . . . . 71.209999999999994 112.998 -176.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -61.45 151.91 76.53 Favored 'Trans proline' 0 N--CA 1.442 -1.509 0 C-N-CA 122.853 2.369 . . . . 72.219999999999999 110.642 173.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -77.68 92.23 4.11 Favored 'General case' 0 C--N 1.275 -2.634 0 CA-C-N 114.817 -1.083 . . . . 73.400000000000006 110.035 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.22 36.07 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.022 0 CA-C-N 112.226 -2.261 . . . . 43.409999999999997 112.456 174.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.66 124.49 19.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 107.717 -1.216 . . . . 65.439999999999998 107.717 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 8.6 p -76.13 150.27 37.24 Favored 'General case' 0 N--CA 1.399 -3.012 0 N-CA-C 109.123 -0.695 . . . . 65.430000000000007 109.123 -175.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.276 2.4 pp -61.7 -30.73 48.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 114.277 1.214 . . . . 70.430000000000007 114.277 -173.133 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . 0.432 ' N ' HD12 ' A' ' 458' ' ' ILE . 0.0 OUTLIER -81.56 -22.27 37.91 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.542 -0.863 . . . . 72.409999999999997 110.04 -177.7 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 20.6 t70 -75.67 -40.23 56.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.162 -0.926 . . . . 75.0 109.177 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 13.7 tt -76.0 -32.28 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 115.214 -0.903 . . . . 71.209999999999994 110.263 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 84.4 mt -72.14 -29.42 64.03 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.348 -0.612 . . . . 75.129999999999995 109.348 176.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 25.8 t70 -63.16 -53.39 54.1 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-N 115.324 -0.853 . . . . 61.43 108.784 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.81 -42.04 64.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 114.539 -1.21 . . . . 73.230000000000004 111.435 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.94 -37.16 78.7 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.828 -0.624 . . . . 53.32 110.982 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 77.36 -140.56 24.68 Favored Glycine 0 N--CA 1.421 -2.32 0 C-N-CA 120.42 -0.895 . . . . 71.120000000000005 112.153 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -48.63 -32.08 7.69 Favored 'General case' 0 C--N 1.291 -1.971 0 C-N-CA 126.238 1.815 . . . . 61.43 113.137 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -66.61 -23.44 66.18 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.965 0.412 . . . . 74.420000000000002 111.393 -177.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.93 -15.48 60.69 Favored 'General case' 0 C--O 1.206 -1.201 0 CA-C-N 116.136 -0.484 . . . . 63.439999999999998 111.532 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.8 m -78.08 -16.83 57.67 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-O 121.389 0.614 . . . . 75.319999999999993 110.387 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . 0.419 ' OD1' ' HB3' ' A' ' 495' ' ' MET . 11.7 t70 -84.69 -11.9 54.94 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 116.274 -0.421 . . . . 73.430000000000007 111.431 -175.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.1 tt -52.39 145.78 2.53 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 124.194 0.998 . . . . 71.120000000000005 111.889 -176.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . 0.423 ' O ' HG12 ' A' ' 472' ' ' ILE . 84.8 mtt180 -75.46 158.06 33.16 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.066 -1.087 . . . . 73.25 108.066 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 7.7 t -57.82 110.45 0.91 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-O 121.416 0.627 . . . . 72.209999999999994 111.065 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 62.29 27.01 16.18 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.57 1.148 . . . . 75.400000000000006 111.088 -176.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.63 19.11 2.06 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 115.276 0.87 . . . . 54.299999999999997 115.276 -176.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.5 p -93.61 110.6 23.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-O 121.536 0.684 . . . . 72.409999999999997 109.714 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -108.85 94.91 5.3 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.571 -1.27 . . . . 71.150000000000006 107.571 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . 0.544 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 53.6 ttm -87.67 139.31 30.66 Favored 'General case' 0 C--N 1.287 -2.133 0 C-N-CA 120.394 -0.522 . . . . 53.409999999999997 109.73 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 66.3 t -81.67 97.85 3.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 N-CA-C 108.826 -0.805 . . . . 74.140000000000001 108.826 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.4 mt -97.26 154.02 17.67 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.369 -1.287 . . . . 73.510000000000005 107.83 178.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -93.32 173.44 7.71 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.391 -1.707 . . . . 74.340000000000003 106.391 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -59.35 -27.51 66.0 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 119.279 0.945 . . . . 74.109999999999999 111.724 -176.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -70.37 -11.84 61.18 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.746 0.819 . . . . 75.219999999999999 111.155 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 82.5 29.03 37.39 Favored Glycine 0 N--CA 1.432 -1.6 0 CA-C-N 116.131 -0.486 . . . . 32.43 112.412 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -123.1 140.24 33.18 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 108.437 -0.949 . . . . 71.450000000000003 108.437 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . 0.544 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 29.7 Cg_endo -63.51 134.23 43.63 Favored 'Trans proline' 0 C--O 1.242 0.707 0 C-N-CA 122.906 2.404 . . . . 64.030000000000001 113.727 -177.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 17.7 m -76.31 -18.58 58.88 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.735 0.779 . . . . 64.239999999999995 109.796 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 106.7 15.85 15.75 Favored Glycine 0 CA--C 1.497 -1.084 0 N-CA-C 111.172 -0.771 . . . . 71.530000000000001 111.172 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -127.42 151.85 48.28 Favored 'General case' 0 C--O 1.256 1.433 0 N-CA-C 105.412 -2.07 . . . . 61.350000000000001 105.412 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -165.21 153.95 12.09 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 118.153 0.433 . . . . 51.520000000000003 110.062 -177.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -125.69 120.13 29.85 Favored 'General case' 0 C--N 1.288 -2.101 0 N-CA-C 108.669 -0.863 . . . . 75.109999999999999 108.669 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 56.7 mt -107.66 130.18 60.42 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.53 0 N-CA-C 107.059 -1.459 . . . . 61.450000000000003 107.059 176.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . 0.477 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 9.3 tt0 -104.5 116.98 33.04 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.155 0.503 . . . . 75.409999999999997 110.155 -177.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.419 ' HB3' ' OD1' ' A' ' 471' ' ' ASP . 0.3 OUTLIER -92.79 172.59 8.25 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.197 -0.91 . . . . 72.219999999999999 110.192 178.09 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.407 ' HG2' ' HG2' ' A' ' 473' ' ' ARG . 36.0 mtmm -88.16 -35.28 17.49 Favored 'General case' 0 N--CA 1.394 -3.253 0 CA-C-N 116.21 -0.45 . . . . 72.209999999999994 110.472 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.4 m -116.25 141.12 48.56 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-O 121.526 0.679 . . . . 44.100000000000001 112.085 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -73.03 -16.12 61.5 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.202 -0.908 . . . . 70.439999999999998 110.969 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -62.03 -56.38 19.57 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.654 -0.703 . . . . 75.209999999999994 109.686 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.27 70.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.082 -0.963 . . . . 71.010000000000005 111.243 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.17 -42.76 83.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.11 -0.496 . . . . 72.219999999999999 110.71 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -66.69 -44.48 81.62 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.072 0.463 . . . . 73.409999999999997 110.287 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 38.5 tpp -71.14 -33.32 69.96 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.75 -0.659 . . . . 74.5 110.991 -175.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.36 -40.55 81.43 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 109.647 -0.501 . . . . 71.109999999999999 109.647 176.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -69.41 -30.19 68.09 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.962 -0.563 . . . . 62.020000000000003 111.537 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -76.34 -40.78 50.4 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 120.811 -0.356 . . . . 74.239999999999995 110.509 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -69.88 -43.3 72.1 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.278 0.561 . . . . 55.409999999999997 110.63 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 61.0 m -99.35 16.75 22.03 Favored 'General case' 0 N--CA 1.415 -2.201 0 N-CA-C 113.529 0.937 . . . . 44.049999999999997 113.529 -173.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . 0.425 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 10.9 t-80 -66.68 91.76 0.2 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.303 -0.559 . . . . 75.010000000000005 110.158 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 99.4 mttt 67.93 35.74 3.69 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 125.037 1.335 . . . . 52.140000000000001 110.758 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -80.35 147.77 30.93 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.614 -1.175 . . . . 74.129999999999995 109.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.49 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 13.8 m120 -74.72 120.3 20.08 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 115.724 -0.671 . . . . 74.25 110.311 178.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.1 ttt -102.15 93.16 5.08 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 106.088 -1.819 . . . . 74.140000000000001 106.088 175.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 67.71 -77.38 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 124.297 1.039 . . . . 73.140000000000001 111.185 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -125.38 -18.49 5.31 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-O 121.811 0.815 . . . . 74.420000000000002 110.713 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 22.7 tpt180 -90.79 160.86 15.56 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.253 -0.885 . . . . 75.420000000000002 109.956 -170.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -113.91 116.26 28.99 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.29 -1.744 . . . . 74.540000000000006 106.29 172.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 92.9 t -110.86 122.0 64.57 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.921 0 CA-C-N 116.33 -0.396 . . . . 63.420000000000002 109.946 -176.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . 0.417 ' OE1' ' HD3' ' A' ' 450' ' ' ARG . 41.7 tt0 -85.71 109.46 18.63 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 107.891 -1.151 . . . . 75.230000000000004 107.891 176.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' A' ' 505' ' ' ALA . 97.5 t -105.02 124.65 59.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.295 -1.372 . . . . 52.109999999999999 107.295 176.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -133.4 138.28 46.2 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.44 -0.948 . . . . 51.109999999999999 108.44 -173.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . 0.415 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 46.4 tt0 -83.16 153.25 24.88 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.626 -0.509 . . . . 73.409999999999997 109.626 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . 0.415 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 5.9 p -162.66 171.5 16.79 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 122.769 0.428 . . . . 74.420000000000002 110.004 -177.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.588 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 1.3 m -97.59 160.47 14.3 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.7 -0.682 . . . . 73.349999999999994 109.429 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.88 -21.71 61.38 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.629 -0.714 . . . . 71.420000000000002 111.535 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.39 -54.1 23.46 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 116.343 -0.39 . . . . 72.030000000000001 110.372 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -38.51 82.7 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 110.215 -0.291 . . . . 75.310000000000002 110.215 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -59.35 -44.77 92.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.857 -0.61 . . . . 72.409999999999997 110.445 177.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -69.32 -40.67 77.49 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.315 0.579 . . . . 71.530000000000001 109.567 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -59.62 -44.53 93.42 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.221 -0.899 . . . . 54.310000000000002 111.271 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.4 t -73.65 -34.6 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 120.38 -0.528 . . . . 61.039999999999999 110.377 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 79.3 mt . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 74.329999999999998 111.443 178.836 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.241 0.647 0 N-CA-C 109.672 -0.492 . . . . 72.219999999999999 109.672 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.538 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 19.8 ptt85 -92.35 65.72 4.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.168 0.985 . . . . 74.219999999999999 111.401 177.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 33.2 p30 -112.75 12.11 19.55 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.294 -0.866 . . . . 74.409999999999997 110.408 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 30.7 m -109.18 145.77 35.25 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 108.752 -0.833 . . . . 62.130000000000003 108.752 -177.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.72 140.07 49.99 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.111 0 N-CA-C 108.248 -1.019 . . . . 55.25 108.248 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -111.6 121.69 45.83 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.07 -1.085 . . . . 70.409999999999997 108.07 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.9 mt -103.41 132.18 49.88 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 106.488 -1.671 . . . . 75.430000000000007 106.488 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -126.86 136.61 52.58 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 118.419 0.554 . . . . 55.350000000000001 109.621 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 516' ' ' ARG . . . 96.09 38.86 4.46 Favored Glycine 0 C--N 1.31 -0.885 0 C-N-CA 120.489 -0.862 . . . . 41.219999999999999 111.654 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.1 mt -83.54 144.33 45.78 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.991 -0.374 . . . . 70.439999999999998 109.991 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . 0.472 ' HB2' ' HB2' ' A' ' 456' ' ' ALA . 31.8 Cg_exo -50.15 143.96 24.0 Favored 'Trans proline' 0 C--O 1.253 1.266 0 C-N-CA 123.113 2.542 . . . . 62.530000000000001 111.065 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -70.88 92.6 0.92 Allowed 'General case' 0 N--CA 1.417 -2.081 0 CA-C-O 122.402 1.096 . . . . 74.140000000000001 111.469 -177.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.87 33.62 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 111.162 -2.744 . . . . 33.130000000000003 112.415 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 453' ' ' PRO . . . -56.01 138.42 49.16 Favored 'General case' 0 C--O 1.246 0.883 0 N-CA-C 109.44 -0.578 . . . . 40.439999999999998 109.44 171.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 28.4 p -78.06 160.22 28.23 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 116.42 -0.354 . . . . 63.420000000000002 111.02 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.472 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 65.4 mt -65.34 -31.93 56.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.262 0.554 . . . . 63.100000000000001 109.601 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -64.01 -40.2 95.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.052 0.453 . . . . 54.310000000000002 110.249 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -70.16 -37.83 75.29 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.428 -0.806 . . . . 73.109999999999999 110.161 -176.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.421 HG22 ' HA ' ' A' ' 458' ' ' ILE . 13.4 tt -74.59 -32.01 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.027 -0.533 . . . . 75.109999999999999 110.651 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -67.31 -35.38 79.32 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.451 0.643 . . . . 53.43 110.001 176.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -65.13 -49.02 71.51 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.621 -0.881 . . . . 64.349999999999994 108.621 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -53.73 -41.92 67.58 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 113.894 -1.503 . . . . 75.129999999999995 111.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.88 -36.68 84.72 Favored 'General case' 0 C--O 1.248 0.998 0 CA-C-N 116.129 -0.487 . . . . 74.430000000000007 111.718 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 84.11 -143.18 21.06 Favored Glycine 0 N--CA 1.422 -2.29 0 C-N-CA 120.099 -1.048 . . . . 61.210000000000001 111.706 -178.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -54.52 -34.27 61.43 Favored 'General case' 0 C--N 1.3 -1.561 0 C-N-CA 123.527 0.731 . . . . 65.219999999999999 111.066 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . 0.411 ' O ' ' HE1' ' A' ' 495' ' ' MET . 95.0 m-85 -61.3 -17.45 53.71 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.559 -0.746 . . . . 73.140000000000001 112.599 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . 0.473 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -68.25 -15.29 63.52 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 120.836 0.35 . . . . 52.340000000000003 111.397 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 17.3 m -84.77 -20.53 30.88 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-O 121.894 0.854 . . . . 52.450000000000003 109.194 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -107.43 15.52 24.8 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.362 -0.835 . . . . 70.040000000000006 112.365 -174.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . 0.473 HG22 ' O ' ' A' ' 469' ' ' ALA . 11.6 tt -82.55 151.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 106.316 -1.735 . . . . 65.0 106.316 170.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 20.8 mtm-85 -100.3 153.76 19.04 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 118.975 -1.09 . . . . 61.140000000000001 111.128 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 10.0 t -62.58 136.27 57.81 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.566 -0.901 . . . . 71.230000000000004 108.566 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 67.9 22.83 8.54 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 122.294 1.045 . . . . 72.219999999999999 109.376 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -88.08 -20.46 49.54 Favored Glycine 0 N--CA 1.423 -2.224 0 C-N-CA 120.701 -0.762 . . . . 62.520000000000003 112.853 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 47.8 t -89.66 115.19 28.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 117.011 0.406 . . . . 63.210000000000001 110.988 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -127.65 98.09 5.08 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.881 -0.785 . . . . 75.219999999999999 108.881 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 86.0 mtp -83.9 139.44 32.61 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.849 -0.426 . . . . 62.210000000000001 109.849 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 43.0 t -84.04 97.98 5.33 Favored 'Isoleucine or valine' 0 C--O 1.251 1.171 0 CA-C-O 121.553 0.692 . . . . 71.140000000000001 109.728 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 65.2 mt -86.14 155.95 20.55 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.885 -1.154 . . . . 71.519999999999996 107.885 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -96.26 -178.67 4.39 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.583 -1.636 . . . . 72.329999999999998 106.583 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 47.5 m-70 -65.62 -9.81 30.21 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 119.022 0.828 . . . . 74.340000000000003 112.235 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . 0.436 ' OE1' ' HD3' ' A' ' 486' ' ' ARG . 35.2 tt0 -81.38 -12.79 58.86 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 123.855 0.862 . . . . 53.439999999999998 108.877 176.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 75.33 29.19 60.49 Favored Glycine 0 CA--C 1.494 -1.242 0 CA-C-N 115.275 -0.875 . . . . 62.329999999999998 111.373 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.436 ' HD3' ' OE1' ' A' ' 484' ' ' GLN . 62.1 mtp85 -133.16 147.96 67.29 Favored Pre-proline 0 C--N 1.308 -1.238 0 N-CA-C 107.945 -1.132 . . . . 63.229999999999997 107.945 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -54.93 134.47 63.57 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 123.734 2.956 . . . . 53.140000000000001 115.061 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.7 m -75.48 -33.98 60.86 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.176 -0.92 . . . . 31.43 108.884 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 137.16 -16.35 3.66 Favored Glycine 0 CA--C 1.493 -1.309 0 N-CA-C 110.806 -0.917 . . . . 54.210000000000001 110.806 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -116.4 158.7 23.09 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-O 121.021 0.439 . . . . 63.25 110.554 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.33 167.69 29.54 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.687 -0.688 . . . . 55.030000000000001 109.53 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -120.08 145.2 47.1 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.064 -0.717 . . . . 72.340000000000003 109.064 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 46.5 mt -133.44 131.89 57.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 N-CA-C 107.665 -1.235 . . . . 74.239999999999995 107.665 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -106.47 124.47 49.65 Favored 'General case' 0 C--N 1.284 -2.269 0 CA-C-O 121.477 0.655 . . . . 74.450000000000003 109.997 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.411 ' HE1' ' O ' ' A' ' 468' ' ' PHE . 96.3 mmm -98.08 170.05 9.18 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.79 -1.095 . . . . 72.109999999999999 110.994 -175.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -65.3 -46.39 80.58 Favored 'General case' 0 C--N 1.28 -2.432 0 C-N-CA 125.894 1.678 . . . . 55.219999999999999 111.738 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.7 m -130.22 142.61 50.55 Favored 'General case' 0 N--CA 1.408 -2.545 0 N-CA-C 108.617 -0.883 . . . . 55.140000000000001 108.617 -172.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.83 74.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.97 0.89 . . . . 75.120000000000005 111.126 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.84 -46.1 66.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 114.294 -1.321 . . . . 74.239999999999995 110.17 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -62.28 -38.26 88.66 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.821 -1.081 . . . . 72.209999999999994 110.293 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.34 -37.93 88.59 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.393 -0.821 . . . . 41.229999999999997 111.204 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.71 -41.46 83.51 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 110.045 -0.354 . . . . 61.219999999999999 110.045 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 54.8 ttm -67.81 -38.93 83.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.301 -0.408 . . . . 62.200000000000003 110.224 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.23 86.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.97 -0.559 . . . . 64.430000000000007 110.354 177.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.03 84.32 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.979 -0.555 . . . . 54.340000000000003 110.894 177.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -64.83 -42.09 95.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.702 -0.481 . . . . 74.120000000000005 109.702 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.05 -45.29 94.2 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.411 0.624 . . . . 65.510000000000005 111.105 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.7 m -94.45 6.75 47.81 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 112.848 0.684 . . . . 61.119999999999997 112.848 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -76.05 108.35 8.9 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.342 -0.849 . . . . 71.109999999999999 108.792 175.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.433 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 44.0 mttp 72.8 17.32 4.39 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.233 1.013 . . . . 64.349999999999994 112.066 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.17 138.27 36.84 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 115.894 -0.593 . . . . 73.340000000000003 109.801 -178.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -76.11 136.08 39.85 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 115.038 -0.983 . . . . 63.340000000000003 111.994 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.4 ttt -129.8 103.25 6.7 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 105.519 -2.03 . . . . 73.25 105.519 175.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 71.3 -78.89 0.04 OUTLIER 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.708 1.203 . . . . 63.210000000000001 110.698 -175.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -138.63 -14.79 1.23 Allowed 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.579 0.704 . . . . 64.010000000000005 111.843 176.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 451' ' ' GLY . 0.4 OUTLIER -92.23 156.46 17.28 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.891 -1.151 . . . . 64.530000000000001 107.891 -175.22 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -109.66 118.84 37.62 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-O 121.492 0.663 . . . . 73.019999999999996 109.321 173.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.9 t -92.35 131.23 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.262 0 N-CA-C 107.855 -1.165 . . . . 73.319999999999993 107.855 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . 0.433 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 42.7 mt-10 -104.94 113.6 27.3 Favored 'General case' 0 N--CA 1.413 -2.31 0 N-CA-C 108.997 -0.742 . . . . 72.219999999999999 108.997 175.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 76.0 t -104.08 129.77 55.78 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.606 -1.179 . . . . 71.409999999999997 111.196 -177.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -127.57 141.94 51.5 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.281 -0.872 . . . . 73.430000000000007 109.076 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -84.0 151.92 24.73 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 117.958 0.345 . . . . 73.219999999999999 111.509 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.4 p -155.31 173.23 16.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 123.621 0.768 . . . . 62.530000000000001 109.746 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.5 p -102.13 159.59 15.25 Favored 'General case' 0 C--N 1.284 -2.266 0 N-CA-C 112.705 0.631 . . . . 71.409999999999997 112.705 -179.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.34 -37.62 67.69 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 123.871 0.869 . . . . 41.329999999999998 112.086 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.94 -35.64 81.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.997 -0.547 . . . . 75.150000000000006 110.713 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.73 -39.77 84.25 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 123.345 0.403 . . . . 61.109999999999999 110.568 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . 0.544 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 42.6 ttm -59.58 -48.45 81.6 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.181 -0.674 . . . . 55.399999999999999 109.181 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.38 -35.49 80.56 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.069 -0.969 . . . . 74.439999999999998 110.203 -179.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -65.76 -42.3 91.02 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.657 -0.701 . . . . 54.409999999999997 110.153 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 88.1 t -72.58 -34.14 46.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 120.932 0.396 . . . . 71.239999999999995 110.5 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.9 mt . . . . . 0 CA--C 1.534 0.346 0 CA-C-O 121.187 0.518 . . . . 50.140000000000001 110.061 176.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.244 0.778 0 N-CA-C 108.536 -0.913 . . . . 62.409999999999997 108.536 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.597 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 26.7 mtp180 -90.82 73.8 6.57 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-O 121.846 0.832 . . . . 75.430000000000007 109.72 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 26.4 p-10 -114.68 14.06 17.48 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 115.011 -0.995 . . . . 71.25 109.87 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 25.4 m -116.3 149.66 38.91 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 107.628 -1.249 . . . . 75.329999999999998 107.628 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -124.34 139.33 50.98 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.449 0 N-CA-C 108.935 -0.765 . . . . 63.530000000000001 108.935 -177.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -109.97 123.49 49.75 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.083 -1.081 . . . . 64.209999999999994 108.083 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 18.2 mt -99.83 144.36 28.98 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 106.979 -1.489 . . . . 73.239999999999995 106.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -141.28 140.0 33.79 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.545 -0.909 . . . . 72.340000000000003 108.545 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 84.06 32.03 24.46 Favored Glycine 0 C--N 1.291 -1.948 0 C-N-CA 120.315 -0.945 . . . . 74.530000000000001 111.727 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.1 138.35 89.75 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 115.981 -0.109 . . . . 74.010000000000005 110.852 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -58.25 144.97 94.95 Favored 'Trans proline' 0 CA--C 1.486 -1.914 0 C-N-CA 122.549 2.166 . . . . 73.519999999999996 111.31 176.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -78.14 106.69 10.19 Favored 'General case' 1 N--CA 1.376 -4.144 0 N-CA-C 106.908 -1.516 . . . . 73.319999999999993 106.908 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.97 29.61 0.02 OUTLIER 'General case' 0 C--N 1.267 -2.986 0 CA-C-N 111.91 -2.404 . . . . 62.149999999999999 112.841 173.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -87.3 120.03 28.17 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.317 -1.364 . . . . 64.109999999999999 107.317 169.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . 0.581 ' HB ' ' OE1' ' A' ' 459' ' ' GLU . 20.1 p -74.39 157.24 36.02 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.389 0.138 . . . . 64.530000000000001 110.917 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.564 ' HA ' HG22 ' A' ' 461' ' ' ILE . 2.7 pp -65.34 -25.0 36.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 CA-C-O 121.19 0.519 . . . . 73.120000000000005 112.093 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . 0.581 ' OE1' ' HB ' ' A' ' 457' ' ' THR . 6.3 mp0 -68.21 -33.75 74.98 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.01 -0.737 . . . . 54.439999999999998 109.01 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -77.18 -34.1 56.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.21 -0.905 . . . . 50.140000000000001 109.646 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.564 HG22 ' HA ' ' A' ' 458' ' ' ILE . 13.4 tt -78.74 -32.2 15.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.983 0 C-N-CA 120.092 -0.643 . . . . 73.340000000000003 111.062 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.82 -30.82 71.1 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.939 -0.476 . . . . 72.219999999999999 110.866 175.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -63.79 -53.28 53.35 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.944 -1.132 . . . . 61.229999999999997 107.944 172.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 461' ' ' ILE . 80.1 t80 -51.92 -41.97 62.41 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 113.297 -1.774 . . . . 72.099999999999994 111.727 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 91.3 mt -64.65 -37.3 87.12 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.725 -0.67 . . . . 75.120000000000005 111.565 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 90.4 -141.85 16.08 Favored Glycine 0 N--CA 1.419 -2.496 0 C-N-CA 120.255 -0.974 . . . . 41.509999999999998 112.253 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.56 -27.88 12.26 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 124.852 1.261 . . . . 62.32 112.186 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -64.63 -13.53 54.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.591 . . . . 71.439999999999998 112.418 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -67.36 -19.92 65.49 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.105 0.478 . . . . 72.019999999999996 111.176 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.2 m -101.71 0.46 36.04 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-O 121.968 0.89 . . . . 63.020000000000003 109.811 176.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . 0.424 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 58.6 m-20 -108.56 6.14 25.72 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 121.816 -0.552 . . . . 63.100000000000001 112.333 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 495' ' ' MET . 7.6 tt -88.74 151.71 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.791 0 N-CA-C 107.61 -1.256 . . . . 43.310000000000002 107.61 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 42.5 ptt85 -78.02 161.88 27.15 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 118.48 -1.288 . . . . 63.299999999999997 109.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 32.7 m -66.69 115.87 6.99 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 115.589 -0.732 . . . . 74.310000000000002 110.483 -175.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 65.44 28.81 11.55 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.616 1.166 . . . . 74.319999999999993 109.741 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -80.0 8.22 52.01 Favored Glycine 0 N--CA 1.442 -0.902 0 CA-C-N 115.448 -0.796 . . . . 62.329999999999998 114.392 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.96 118.85 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.812 -0.811 . . . . 41.350000000000001 108.812 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -117.18 135.35 53.84 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 107.34 -1.356 . . . . 65.200000000000003 107.34 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 52.7 tpp -116.05 138.52 51.15 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 108.861 -0.792 . . . . 62.219999999999999 108.861 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.05 106.01 16.03 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.128 0 N-CA-C 108.327 -0.99 . . . . 43.450000000000003 108.327 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 60.1 mt -89.8 147.39 23.83 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 106.344 -1.725 . . . . 73.329999999999998 106.344 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -90.33 -169.38 2.39 Favored 'General case' 0 C--N 1.27 -2.882 0 CA-C-N 115.919 -0.582 . . . . 51.299999999999997 109.915 -176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -62.64 -29.06 70.34 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.526 0.679 . . . . 60.130000000000003 110.362 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -79.99 -7.0 58.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.542 -0.753 . . . . 74.310000000000002 110.55 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . 0.456 ' C ' ' HD2' ' A' ' 486' ' ' ARG . . . 79.36 21.88 66.22 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 116.263 -0.426 . . . . 71.030000000000001 113.075 176.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.456 ' HD2' ' C ' ' A' ' 485' ' ' GLY . 8.5 mpt_? -120.31 151.32 53.29 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 108.667 -0.864 . . . . 71.450000000000003 108.667 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.15 123.38 13.7 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.467 2.112 . . . . 72.310000000000002 112.574 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 13.0 m -74.92 -8.35 56.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.689 -0.687 . . . . 71.329999999999998 111.004 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 87.74 16.43 59.92 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.368 -1.093 . . . . 42.409999999999997 110.368 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -125.56 132.78 52.5 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 103.968 -2.605 . . . . 54.219999999999999 103.968 -178.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -148.56 167.08 26.34 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 118.381 0.537 . . . . 53.5 110.42 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 85.4 m-85 -135.48 120.59 18.82 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 123.231 0.612 . . . . 74.329999999999998 109.606 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.4 mt -110.54 131.96 60.23 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 108.054 -1.091 . . . . 71.140000000000001 108.054 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -103.91 124.78 49.59 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 108.568 -0.901 . . . . 71.129999999999995 108.568 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.417 ' HA ' ' HA ' ' A' ' 472' ' ' ILE . 91.1 mmm -98.7 175.05 6.12 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.272 0.558 . . . . 73.25 111.304 -174.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -71.8 -34.77 69.66 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 124.933 1.293 . . . . 60.420000000000002 110.55 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 30.6 t -152.18 153.59 34.14 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 115.007 -0.997 . . . . 75.25 109.962 -172.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.2 75.36 Favored 'General case' 0 CA--C 1.508 -0.673 0 C-N-CA 123.814 0.846 . . . . 71.430000000000007 110.815 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -59.09 -48.23 82.37 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 122.488 1.137 . . . . 61.43 109.959 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . 0.424 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 1.5 mmp_? -65.7 -40.98 92.86 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 113.227 -1.806 . . . . 74.340000000000003 109.832 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.97 -40.99 87.59 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.281 -0.872 . . . . 73.319999999999993 110.581 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -66.12 -38.35 87.97 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.647 -0.706 . . . . 74.019999999999996 110.93 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 83.8 mtp -75.63 -36.31 60.24 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 119.482 -0.887 . . . . 64.019999999999996 110.965 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.22 -41.1 90.56 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.283 -0.417 . . . . 75.219999999999999 110.596 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.76 -36.18 80.06 Favored 'General case' 0 C--O 1.203 -1.371 0 CA-C-N 116.067 -0.515 . . . . 55.240000000000002 110.38 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -44.72 82.06 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.477 -0.329 . . . . 75.140000000000001 110.898 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -63.45 -43.55 97.07 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.668 0.605 . . . . 73.209999999999994 111.369 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.8 m -101.67 10.99 39.6 Favored 'General case' 0 N--CA 1.432 -1.354 0 N-CA-C 112.726 0.639 . . . . 54.049999999999997 112.726 -173.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . 0.47 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 44.0 t60 -70.4 97.56 1.29 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 119.853 -0.739 . . . . 75.329999999999998 109.206 176.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 66.4 66.24 0.47 Allowed 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 125.156 1.383 . . . . 74.120000000000005 110.203 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.3 tptt -112.79 140.81 47.26 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.323 -1.762 . . . . 72.430000000000007 108.818 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -86.32 132.46 33.97 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 120.211 -0.596 . . . . 72.409999999999997 110.596 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.3 ttt -118.26 88.66 2.96 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 106.13 -1.804 . . . . 72.209999999999994 106.13 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt 68.99 -83.52 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.059 -1.428 . . . . 74.010000000000005 113.01 -176.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -121.87 -9.77 8.76 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.393 0.616 . . . . 70.129999999999995 110.833 -173.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -115.24 156.65 24.99 Favored 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 108.518 -0.919 . . . . 71.450000000000003 108.518 -173.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -108.85 121.45 45.11 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 121.112 0.482 . . . . 73.129999999999995 109.787 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . 0.425 HG12 HG23 ' A' ' 520' ' ' VAL . 60.5 t -102.9 114.04 41.34 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.951 0 CA-C-N 114.53 -1.214 . . . . 74.430000000000007 108.153 -178.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -104.51 110.37 22.62 Favored 'General case' 0 C--N 1.279 -2.497 0 N-CA-C 107.625 -1.25 . . . . 65.420000000000002 107.625 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . 0.425 HG23 HG12 ' A' ' 518' ' ' VAL . 73.5 t -104.82 129.02 58.04 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 CA-C-N 115.709 -0.678 . . . . 63.420000000000002 111.336 -175.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -116.06 152.11 34.23 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.325 -0.991 . . . . 75.319999999999993 108.325 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -90.99 157.81 17.07 Favored 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 106.835 -1.542 . . . . 74.010000000000005 106.835 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -157.69 160.51 38.03 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.405 0.622 . . . . 71.420000000000002 112.422 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.597 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 38.1 t -86.09 150.83 24.16 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.727 -1.124 . . . . 71.400000000000006 109.037 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.01 -30.03 67.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.208 0.528 . . . . 72.439999999999998 110.189 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -65.85 -51.47 58.6 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.56 1.144 . . . . 75.129999999999995 109.572 176.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -64.81 -37.48 87.76 Favored 'General case' 0 C--N 1.297 -1.69 0 C-N-CA 126.067 1.747 . . . . 72.25 109.798 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . 0.441 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.2 ttt -67.03 -44.63 79.76 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.315 -0.857 . . . . 70.409999999999997 109.566 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -65.57 -38.11 88.6 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.874 -0.603 . . . . 61.43 109.779 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -59.31 -45.88 90.1 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.43 -0.805 . . . . 74.299999999999997 110.742 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 60.4 t -68.89 -39.65 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 120.18 -0.608 . . . . 74.510000000000005 110.326 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.5 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.489 . . . . 71.140000000000001 112.22 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 36.6 t . . . . . 0 C--O 1.249 1.067 0 N-CA-C 107.712 -1.218 . . . . 63.450000000000003 107.712 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.57 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.6 mtm180 -88.1 75.76 8.63 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 108.507 -0.923 . . . . 72.439999999999998 108.507 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -116.18 11.17 15.12 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.173 -1.376 . . . . 75.400000000000006 112.196 -171.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 56.6 m -106.63 152.43 23.76 Favored 'General case' 0 N--CA 1.407 -2.575 0 C-N-CA 119.547 -0.861 . . . . 65.430000000000007 109.464 -176.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -122.26 140.13 47.09 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.109 0 N-CA-C 106.495 -1.669 . . . . 75.349999999999994 106.495 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . 0.54 ' HD3' ' NH2' ' A' ' 450' ' ' ARG . 20.1 ttm180 -115.4 125.45 53.17 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.052 -0.722 . . . . 61.409999999999997 109.052 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 8.7 mt -107.12 145.66 32.22 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 107.647 -1.242 . . . . 62.210000000000001 107.647 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . 0.54 ' NH2' ' HD3' ' A' ' 448' ' ' ARG . 2.7 ptp180 -149.31 130.81 14.82 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 121.08 0.467 . . . . 75.25 111.706 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 111.02 29.95 3.35 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.407 -0.815 . . . . 25.5 111.094 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 91.4 mt -70.6 133.12 86.93 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 111.665 0.246 . . . . 75.409999999999997 111.665 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . 0.496 ' HA ' ' CZ ' ' A' ' 516' ' ' ARG . 31.3 Cg_exo -58.58 164.64 9.0 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 123.305 2.67 . . . . 72.349999999999994 113.389 175.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -77.47 100.15 5.91 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.964 -1.471 . . . . 70.140000000000001 108.179 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.61 32.62 0.02 OUTLIER 'General case' 0 C--N 1.277 -2.544 0 CA-C-N 111.756 -2.475 . . . . 73.120000000000005 111.421 173.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.85 113.62 3.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.024 -1.102 . . . . 61.5 108.024 171.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 72.8 p -84.26 170.47 13.67 Favored 'General case' 0 N--CA 1.426 -1.642 0 CA-C-O 120.98 0.419 . . . . 62.049999999999997 112.048 -173.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.587 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 35.9 pt -63.68 -24.85 36.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.689 -0.687 . . . . 70.25 110.255 174.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.86 -43.04 37.66 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.254 -0.647 . . . . 72.230000000000004 109.254 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . 0.535 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 7.9 t70 -69.64 -32.29 70.88 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.286 -0.87 . . . . 74.129999999999995 109.845 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.453 HG22 ' HA ' ' A' ' 458' ' ' ILE . 11.7 tt -74.53 -29.02 23.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 C-N-CA 120.293 -0.563 . . . . 73.209999999999994 110.288 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 85.6 mt -65.45 -36.06 82.76 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.564 -0.532 . . . . 70.400000000000006 109.564 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . 0.535 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 22.6 t70 -57.38 -56.23 24.48 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.371 -0.831 . . . . 63.210000000000001 109.074 171.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -53.3 -40.47 64.77 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 113.506 -1.679 . . . . 71.25 111.82 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 82.3 mt -73.26 -37.29 66.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.654 -0.703 . . . . 64.549999999999997 112.357 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.49 -137.16 39.62 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 119.762 -1.209 . . . . 72.540000000000006 112.09 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -57.43 -21.89 39.69 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 124.632 1.173 . . . . 73.430000000000007 112.354 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -69.39 -10.14 56.62 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.372 0.508 . . . . 71.219999999999999 112.372 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -65.98 -15.22 62.81 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.353 0.597 . . . . 73.230000000000004 110.933 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 13.9 m -87.54 -14.87 39.07 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-O 121.115 0.483 . . . . 64.209999999999994 111.014 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.2 6.69 20.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.64 0.978 . . . . 64.439999999999998 113.64 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 8.9 tt -90.58 151.47 3.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 N-CA-C 108.524 -0.917 . . . . 74.329999999999998 108.524 175.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -78.78 148.18 33.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.093 -0.706 . . . . 63.350000000000001 109.093 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 29.1 m -51.43 109.97 0.4 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.359 1.064 . . . . 64.340000000000003 112.777 -175.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 34.6 m170 64.13 28.68 14.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.509 1.124 . . . . 73.420000000000002 110.707 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.42 20.58 8.57 Favored Glycine 0 N--CA 1.43 -1.74 0 CA-C-N 114.986 -1.006 . . . . 42.200000000000003 113.453 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.83 106.15 17.57 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 N-CA-C 106.67 -1.604 . . . . 64.420000000000002 106.67 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -114.35 93.27 4.27 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 109.153 -0.684 . . . . 74.439999999999998 109.153 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . 0.402 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 1.5 pmm? -83.82 142.68 30.46 Favored 'General case' 0 C--N 1.294 -1.844 0 C-N-CA 120.564 -0.455 . . . . 64.329999999999998 109.935 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 57.3 t -76.74 124.92 35.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 106.581 -1.637 . . . . 74.099999999999994 106.581 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.23 154.95 18.55 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.16 0.505 . . . . 70.329999999999998 109.996 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -96.04 172.02 8.26 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 105.775 -1.935 . . . . 71.329999999999998 105.775 176.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -65.51 -5.18 7.22 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.693 0.997 . . . . 65.510000000000005 113.693 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . 0.472 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 36.2 tt0 -92.56 -1.11 57.17 Favored 'General case' 0 CA--C 1.555 1.17 0 CA-C-O 121.984 0.897 . . . . 70.230000000000004 109.25 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.19 30.65 62.56 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.629 -0.714 . . . . 65.140000000000001 112.83 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.472 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 93.9 mtt180 -127.81 148.6 67.7 Favored Pre-proline 0 C--N 1.306 -1.287 0 N-CA-C 107.905 -1.146 . . . . 71.439999999999998 107.905 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.92 133.45 54.82 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.08 2.52 . . . . 54.420000000000002 113.531 -177.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.9 m -73.73 -17.91 61.06 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 123.888 0.875 . . . . 73.099999999999994 111.165 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 118.02 -20.14 10.79 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 110.444 -1.062 . . . . 64.120000000000005 110.444 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -108.33 148.52 29.94 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 106.543 -1.651 . . . . 63.509999999999998 106.543 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.402 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -159.71 171.13 20.1 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 117.903 0.32 . . . . 55.039999999999999 110.803 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . 0.436 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 98.3 m-85 -128.55 151.08 49.85 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.605 -0.725 . . . . 63.530000000000001 109.511 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 50.7 mt -131.14 137.41 55.78 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.737 0 N-CA-C 105.849 -1.908 . . . . 62.549999999999997 105.849 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -110.72 115.89 30.35 Favored 'General case' 0 C--N 1.276 -2.622 0 C-N-CA 119.197 -1.001 . . . . 74.239999999999995 109.223 177.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.405 ' CG ' ' HB3' ' A' ' 500' ' ' ARG . 3.2 tpt -92.73 167.09 12.11 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.718 -1.128 . . . . 64.340000000000003 108.996 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.411 ' HB3' ' HG2' ' A' ' 500' ' ' ARG . 39.7 ttmt -53.24 -45.45 68.75 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.95 1.3 . . . . 75.209999999999994 112.295 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 22.6 m -147.65 168.4 22.14 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.282 -0.872 . . . . 61.200000000000003 110.0 -173.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.47 93.86 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 123.863 0.727 . . . . 73.530000000000001 111.911 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -69.2 -37.69 78.22 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 108.912 -0.773 . . . . 73.430000000000007 108.912 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . 0.411 ' HG2' ' HB3' ' A' ' 496' ' ' LYS . 0.0 OUTLIER -58.69 -47.75 83.45 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.228 -1.351 . . . . 71.400000000000006 110.2 175.268 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -64.02 -39.06 93.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 65.109999999999999 110.495 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.75 -44.87 95.07 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.653 -0.703 . . . . 74.209999999999994 110.878 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 26.4 ttt -69.0 -37.23 78.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.146 -0.479 . . . . 73.230000000000004 110.18 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.99 83.17 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.81 -0.632 . . . . 65.409999999999997 110.515 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.85 -38.96 87.38 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.191 -0.458 . . . . 61.240000000000002 110.65 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -66.91 -41.4 87.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.12 0.486 . . . . 51.329999999999998 109.987 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -64.34 -40.26 95.53 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.578 -0.737 . . . . 72.239999999999995 111.36 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . 0.401 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 22.9 m -107.86 13.77 26.02 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 113.252 0.834 . . . . 71.230000000000004 113.252 -173.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -67.89 98.29 0.73 Allowed 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.884 -0.51 . . . . 73.219999999999999 109.714 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 85.8 tttt 66.09 54.5 0.98 Allowed 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.95 1.3 . . . . 72.430000000000007 109.604 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 54.2 tptt -93.26 140.35 29.63 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.701 -1.59 . . . . 60.119999999999997 109.023 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -84.7 113.7 21.49 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-O 121.077 0.465 . . . . 75.310000000000002 109.815 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 23.9 ttt -94.41 93.3 7.59 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 105.345 -2.094 . . . . 61.439999999999998 105.345 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 13.3 mptt 68.1 -82.26 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.871 -1.059 . . . . 72.049999999999997 111.333 -173.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -131.77 0.45 3.93 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 112.077 0.399 . . . . 71.420000000000002 112.077 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . 0.496 ' CZ ' ' HA ' ' A' ' 453' ' ' PRO . 15.8 ttm180 -118.49 146.54 44.44 Favored 'General case' 0 C--N 1.298 -1.671 0 C-N-CA 119.848 -0.741 . . . . 55.409999999999997 109.166 -176.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -89.59 120.76 31.17 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 109.111 -0.7 . . . . 74.329999999999998 109.111 -177.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 71.2 t -107.39 115.11 47.95 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.825 0 N-CA-C 107.246 -1.391 . . . . 73.409999999999997 107.246 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -94.19 112.75 24.59 Favored 'General case' 0 C--N 1.285 -2.21 0 N-CA-C 108.287 -1.005 . . . . 74.209999999999994 108.287 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -105.2 128.7 58.89 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.084 0 CA-C-N 115.439 -0.801 . . . . 63.420000000000002 110.373 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -128.83 159.55 35.39 Favored 'General case' 0 C--O 1.211 -0.924 0 C-N-CA 123.309 0.643 . . . . 71.049999999999997 109.302 -178.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . 0.446 HE21 ' N ' ' A' ' 523' ' ' CYS . 1.0 OUTLIER -93.22 143.92 25.79 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.401 -0.592 . . . . 62.32 109.401 178.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . 0.446 ' N ' HE21 ' A' ' 522' ' ' GLN . 7.3 p -141.6 171.1 14.52 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 122.872 0.469 . . . . 53.200000000000003 111.4 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.9 m -98.64 144.89 27.43 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 115.698 -0.683 . . . . 74.439999999999998 111.261 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . 0.408 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -62.84 -31.91 73.02 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.817 0.673 . . . . 75.439999999999998 112.817 -177.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.69 -41.12 92.79 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.943 0.402 . . . . 74.140000000000001 110.469 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 531' ' ' VAL . 35.8 tt0 -72.2 -39.03 68.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.394 0.616 . . . . 71.439999999999998 109.358 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -62.66 -44.04 97.28 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.1 -0.954 . . . . 73.430000000000007 109.71 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.48 -30.29 68.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.198 0.523 . . . . 64.519999999999996 110.411 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -65.71 -45.2 83.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.616 -0.72 . . . . 72.420000000000002 109.575 178.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 527' ' ' GLU . 58.3 t -67.02 -38.62 81.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.98 -0.555 . . . . 63.219999999999999 110.08 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 65.5 mt . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 121.013 0.435 . . . . 75.299999999999997 111.487 178.384 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . 0.474 ' HB ' ' OD2' ' A' ' 445' ' ' ASP . 25.5 t . . . . . 0 C--O 1.242 0.689 0 N-CA-C 107.273 -1.38 . . . . 73.150000000000006 107.273 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.555 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.0 mtp85 -84.63 52.53 2.41 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 122.154 0.978 . . . . 73.420000000000002 109.731 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . 0.474 ' OD2' ' HB ' ' A' ' 443' ' ' VAL . 3.3 p30 -101.65 2.47 38.79 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.801 -1.091 . . . . 71.109999999999999 111.023 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 23.3 m -110.96 141.31 44.58 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 118.869 -1.132 . . . . 40.109999999999999 109.012 -174.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -120.62 144.17 30.32 Favored 'Isoleucine or valine' 0 C--N 1.26 -3.318 0 N-CA-C 107.704 -1.221 . . . . 61.200000000000003 107.704 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . 0.549 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 28.0 ttp180 -119.67 124.97 47.57 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.333 0.587 . . . . 73.010000000000005 109.815 173.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 8.6 mt -93.75 133.54 37.02 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 105.907 -1.886 . . . . 75.329999999999998 105.907 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . 0.453 ' HD3' ' C ' ' A' ' 450' ' ' ARG . 2.0 tmt_? -128.17 130.96 48.87 Favored 'General case' 0 C--N 1.277 -2.586 0 CA-C-O 121.221 0.534 . . . . 74.010000000000005 109.667 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . 0.438 ' O ' HG22 ' A' ' 518' ' ' VAL . . . 95.48 47.92 2.46 Favored Glycine 0 C--N 1.283 -2.365 0 N-CA-C 110.248 -1.141 . . . . 34.240000000000002 110.248 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 83.3 mt -72.63 148.69 90.34 Favored Pre-proline 0 C--N 1.312 -1.035 0 N-CA-C 111.763 0.282 . . . . 73.420000000000002 111.763 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.04 179.35 0.8 Allowed 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.701 2.267 . . . . 65.230000000000004 111.161 173.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -77.74 87.61 3.99 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 115.527 -0.761 . . . . 72.25 111.631 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 63.88 41.83 6.44 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 113.045 -1.889 . . . . 73.239999999999995 111.427 169.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -50.0 125.28 11.71 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 114.999 -1.0 . . . . 71.230000000000004 108.414 171.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 1.6 p -72.24 162.46 29.44 Favored 'General case' 0 N--CA 1.419 -1.99 0 N-CA-C 113.409 0.892 . . . . 73.120000000000005 113.409 -170.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.462 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.1 pt -60.25 -27.54 39.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 113.871 1.063 . . . . 73.25 113.871 -172.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.77 -26.68 34.25 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.129 -1.028 . . . . 65.510000000000005 110.38 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . 0.594 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 5.2 t70 -78.34 -28.48 47.24 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.019 -0.537 . . . . 75.140000000000001 110.462 -178.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.418 HG22 ' O ' ' A' ' 458' ' ' ILE . 15.4 tt -70.18 -32.04 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 C-N-CA 119.617 -0.833 . . . . 73.099999999999994 108.832 175.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 88.3 mt -70.71 -36.07 73.05 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.311 0.577 . . . . 72.319999999999993 109.507 176.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . 0.594 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 6.3 t70 -55.48 -55.96 25.8 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.746 -1.115 . . . . 72.230000000000004 108.825 173.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 113.749 -1.569 . . . . 75.150000000000006 111.598 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 57.9 mt -67.42 -29.96 69.59 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 113.062 0.764 . . . . 64.239999999999995 113.062 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.95 -137.92 26.15 Favored Glycine 0 N--CA 1.425 -2.066 0 C-N-CA 119.161 -1.495 . . . . 14.44 111.72 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -58.09 -28.12 64.3 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.699 -0.75 . . . . 63.219999999999999 112.372 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -70.67 -11.2 60.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.24 0.459 . . . . 72.25 112.24 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -64.44 -22.22 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.175 0.805 . . . . 34.439999999999998 113.175 -176.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 11.7 t -101.7 -3.15 28.71 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.618 0.723 . . . . 71.030000000000001 110.49 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.99 3.27 41.42 Favored 'General case' 0 C--O 1.245 0.841 0 CA-C-O 121.235 0.541 . . . . 72.5 111.319 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 10.4 tt -75.49 148.49 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.287 0 N-CA-C 107.627 -1.249 . . . . 75.230000000000004 107.627 173.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 62.2 mtm180 -79.38 164.85 23.7 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 120.113 -0.635 . . . . 75.409999999999997 110.967 176.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 8.8 m -52.87 107.12 0.2 Allowed 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.973 0.909 . . . . 71.230000000000004 112.128 -174.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 60.88 27.7 17.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.119 0.968 . . . . 64.140000000000001 111.629 177.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -72.85 -1.45 55.0 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.106 -0.952 . . . . 43.009999999999998 114.576 -176.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.8 p -86.42 115.26 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 CA-C-O 121.866 0.841 . . . . 64.409999999999997 109.622 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -124.64 96.77 5.02 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.851 -0.613 . . . . 61.030000000000001 109.85 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . 0.489 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 62.0 mtt -77.75 133.97 38.16 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.477 -0.934 . . . . 73.349999999999994 108.477 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 58.5 t -78.12 101.57 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.314 0 N-CA-C 107.551 -1.277 . . . . 61.420000000000002 107.551 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 73.8 mt -93.35 156.67 16.65 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-N 115.495 -0.775 . . . . 45.109999999999999 110.309 -177.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -103.31 179.76 4.18 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 105.878 -1.897 . . . . 73.239999999999995 105.878 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -55.57 -38.72 69.73 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 124.054 0.941 . . . . 54.509999999999998 112.424 -174.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.93 -1.85 27.52 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.274 0.559 . . . . 74.140000000000001 111.941 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 78.69 31.95 42.99 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.783 -0.722 . . . . 45.119999999999997 111.898 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -118.01 139.78 27.02 Favored Pre-proline 0 C--N 1.307 -1.264 0 N-CA-C 107.577 -1.268 . . . . 74.049999999999997 107.577 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.47 134.17 49.96 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.051 1.834 . . . . 73.299999999999997 110.987 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.8 m -75.94 1.87 14.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.647 0.737 . . . . 53.310000000000002 110.929 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.71 -30.76 6.23 Favored Glycine 0 CA--C 1.49 -1.481 0 CA-C-N 115.452 -0.794 . . . . 73.310000000000002 112.145 175.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . 0.479 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.1 p-10 -113.45 149.9 33.56 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-O 121.184 0.516 . . . . 55.119999999999997 111.639 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -150.75 155.56 39.52 Favored 'General case' 0 C--O 1.204 -1.31 0 CA-C-N 115.497 -0.774 . . . . 55.299999999999997 109.533 -177.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . 0.549 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 81.5 m-85 -111.28 146.09 37.62 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-O 121.189 0.519 . . . . 65.150000000000006 111.42 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 61.1 mt -126.51 122.13 60.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 106.52 -1.659 . . . . 75.430000000000007 106.52 172.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -100.96 114.08 27.65 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 115.633 -0.712 . . . . 64.530000000000001 109.907 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 94.9 mmm -92.88 172.94 8.01 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.4 0.619 . . . . 64.140000000000001 111.419 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -75.51 -40.47 57.03 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.045 -0.979 . . . . 74.099999999999994 110.192 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 41.5 t -140.98 150.81 43.56 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 116.268 -0.423 . . . . 73.400000000000006 110.289 -175.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.56 -29.79 70.45 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 123.969 0.908 . . . . 73.409999999999997 112.324 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -64.08 -42.84 96.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.868 0.842 . . . . 74.019999999999996 109.693 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -68.53 -38.73 81.09 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 114.534 -1.212 . . . . 72.129999999999995 110.463 177.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.35 90.81 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.891 -0.595 . . . . 53.020000000000003 110.975 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -68.78 -42.26 77.67 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.848 -0.427 . . . . 74.140000000000001 109.848 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 51.1 ttm -64.26 -40.91 96.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.987 -0.551 . . . . 74.409999999999997 110.486 -177.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.37 -39.95 81.61 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 116.226 -0.443 . . . . 54.130000000000003 110.188 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.89 -37.22 81.5 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 116.17 -0.468 . . . . 65.010000000000005 111.123 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -65.32 -44.58 87.39 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.944 -0.391 . . . . 54.539999999999999 109.944 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -66.09 -39.95 90.4 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.87 -0.605 . . . . 72.329999999999998 110.583 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 38.2 m -99.43 12.38 36.53 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 113.259 0.837 . . . . 74.319999999999993 113.259 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -70.23 95.69 1.03 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.365 -0.834 . . . . 63.310000000000002 109.891 176.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.1 tttt 64.33 62.65 0.81 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.977 1.711 . . . . 75.409999999999997 110.056 -177.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -108.14 148.56 29.68 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 112.641 -2.072 . . . . 61.229999999999997 108.803 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -77.12 119.87 21.42 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.176 0.512 . . . . 62.450000000000003 110.221 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.6 ttt -103.98 80.32 1.73 Allowed 'General case' 0 N--CA 1.404 -2.729 0 N-CA-C 105.584 -2.006 . . . . 61.229999999999997 105.584 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . 0.501 ' HD2' ' N ' ' A' ' 514' ' ' LYS . 0.1 OUTLIER 68.8 -75.75 0.06 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 113.601 -1.636 . . . . 72.340000000000003 112.204 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -106.09 -31.79 8.55 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 113.292 0.849 . . . . 54.549999999999997 113.292 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -110.61 157.79 19.3 Favored 'General case' 0 C--N 1.273 -2.719 0 CA-C-N 115.788 -0.642 . . . . 74.310000000000002 110.542 -168.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -95.32 126.89 40.94 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.467 -1.679 . . . . 54.509999999999998 106.467 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 451' ' ' GLY . 66.7 t -114.06 120.28 63.42 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.678 0 N-CA-C 108.795 -0.817 . . . . 73.420000000000002 108.795 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.83 112.47 22.51 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 107.785 -1.191 . . . . 75.200000000000003 107.785 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -103.69 129.68 55.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 109.963 -0.384 . . . . 53.32 109.963 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.662 -0.699 . . . . 74.200000000000003 109.244 -177.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . 0.465 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 42.0 tt0 -87.63 155.64 19.85 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.038 -1.097 . . . . 63.350000000000001 108.038 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . 0.465 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 7.9 p -162.05 171.69 17.12 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.461 0.648 . . . . 74.109999999999999 110.942 -178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 60.3 p -91.88 155.35 18.25 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.104 -0.953 . . . . 72.439999999999998 110.167 177.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.67 -27.82 52.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.316 -0.856 . . . . 71.540000000000006 111.433 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.32 -51.87 67.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 55.240000000000002 109.168 176.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.7 -37.42 87.27 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.338 -0.846 . . . . 74.230000000000004 109.883 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . 0.456 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 24.8 ttt -61.56 -46.85 88.14 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.695 -0.684 . . . . 74.209999999999994 110.848 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -73.4 -28.97 62.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.925 -0.71 . . . . 73.319999999999993 109.639 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.33 -47.86 82.36 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 115.739 -0.664 . . . . 72.420000000000002 110.231 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.7 t -69.76 -34.54 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 120.826 -0.35 . . . . 75.140000000000001 110.276 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.3 mt . . . . . 0 C--N 1.327 -0.392 0 CA-C-O 120.903 0.382 . . . . 71.129999999999995 111.094 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 C--O 1.245 0.819 0 N-CA-C 109.465 -0.569 . . . . 74.049999999999997 109.465 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.542 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 54.4 mtm180 -80.87 63.78 5.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.805 0.812 . . . . 74.340000000000003 109.758 176.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 40.7 p-10 -95.79 4.21 53.08 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 115.31 -0.859 . . . . 64.040000000000006 110.012 -175.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.597 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 39.3 m -102.7 149.43 24.45 Favored 'General case' 0 N--CA 1.411 -2.419 0 CA-C-O 121.616 0.722 . . . . 75.209999999999994 110.618 -174.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . 0.64 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.4 mt -125.46 145.4 32.89 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.738 0 CA-C-N 114.608 -1.178 . . . . 54.530000000000001 107.95 178.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -119.83 120.37 36.27 Favored 'General case' 0 N--CA 1.416 -2.161 0 N-CA-C 106.472 -1.677 . . . . 75.200000000000003 106.472 172.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 13.0 mt -103.93 131.5 51.1 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 106.741 -1.578 . . . . 75.239999999999995 106.741 -178.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -132.82 142.98 49.25 Favored 'General case' 0 C--N 1.257 -3.415 0 N-CA-C 108.497 -0.927 . . . . 71.120000000000005 108.497 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 96.4 26.24 11.27 Favored Glycine 0 C--N 1.289 -2.03 0 C-N-CA 120.052 -1.07 . . . . 63.340000000000003 110.765 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 64.3 mt -72.95 144.25 85.07 Favored Pre-proline 0 C--N 1.304 -1.376 0 N-CA-C 109.276 -0.638 . . . . 64.510000000000005 109.276 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -55.41 161.13 7.75 Favored 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.883 2.389 . . . . 70.510000000000005 112.001 175.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -77.35 90.63 3.79 Favored 'General case' 0 N--CA 1.411 -2.417 0 CA-C-N 115.067 -0.97 . . . . 72.040000000000006 111.04 -177.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.11 29.93 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 112.085 -2.325 . . . . 74.140000000000001 112.672 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.15 140.79 52.66 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.3 -1.37 . . . . 74.5 107.3 170.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 68.2 p -86.43 174.39 9.02 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 120.345 -0.542 . . . . 72.030000000000001 111.709 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.429 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 72.0 mt -63.97 -37.37 79.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 108.998 -0.742 . . . . 74.040000000000006 108.998 177.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.15 -37.6 87.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.86 -0.609 . . . . 73.209999999999994 109.811 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -65.75 -42.85 90.43 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.806 -0.634 . . . . 65.109999999999999 110.706 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 9.3 tp -72.71 -33.39 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 119.98 -0.688 . . . . 71.200000000000003 110.681 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -68.88 -32.86 72.83 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.156 0.503 . . . . 63.130000000000003 109.668 177.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.77 -52.71 59.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-N 115.127 -0.942 . . . . 51.549999999999997 108.766 176.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.26 -41.29 79.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.078 -1.419 . . . . 62.299999999999997 111.325 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 67.9 mt -67.78 -32.6 73.29 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.892 -0.594 . . . . 73.200000000000003 111.859 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.06 -124.09 7.61 Favored Glycine 0 N--CA 1.418 -2.537 0 C-N-CA 119.377 -1.392 . . . . 63.439999999999998 113.129 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -42.58 -42.21 3.31 Favored 'General case' 0 C--N 1.287 -2.146 0 C-N-CA 126.693 1.997 . . . . 72.530000000000001 112.625 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -66.16 -12.37 55.43 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.359 -0.837 . . . . 52.030000000000001 112.785 -172.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.35 -15.7 60.93 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.406 0.622 . . . . 60.310000000000002 110.352 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.5 m -85.23 -28.03 25.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.63 0.729 . . . . 53.229999999999997 110.238 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -106.75 15.68 25.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.906 0.86 . . . . 74.019999999999996 110.631 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -68.43 142.6 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 N-CA-C 108.856 -0.794 . . . . 62.43 108.856 176.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.15 143.36 33.93 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 106.142 -1.799 . . . . 70.319999999999993 106.142 178.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 22.3 m -54.8 106.86 0.24 Allowed 'General case' 0 C--N 1.298 -1.635 0 O-C-N 124.254 0.971 . . . . 75.109999999999999 111.944 -172.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 27.0 m170 60.72 35.03 19.79 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.026 0.93 . . . . 73.400000000000006 111.729 -177.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -83.41 -0.39 90.02 Favored Glycine 0 N--CA 1.432 -1.625 0 CA-C-N 115.004 -0.998 . . . . 65.120000000000005 111.422 175.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 5.5 p -82.06 127.86 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 CA-C-O 121.221 0.534 . . . . 73.400000000000006 110.05 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -138.77 96.83 3.2 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.054 -1.091 . . . . 73.140000000000001 108.054 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . 0.507 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 55.4 ttm -78.24 139.75 38.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.366 -0.605 . . . . 74.5 109.366 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 74.7 t -94.29 110.61 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.726 0 CA-C-O 122.105 0.955 . . . . 73.209999999999994 111.136 -176.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.47 ' H ' HD23 ' A' ' 481' ' ' LEU . 0.7 OUTLIER -104.59 159.8 15.46 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.189 -1.368 . . . . 70.230000000000004 108.142 175.126 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -114.04 -168.97 1.43 Allowed 'General case' 0 C--N 1.273 -2.742 0 N-CA-C 108.435 -0.95 . . . . 72.349999999999994 108.435 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 31.9 t60 -54.14 -28.71 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 124.006 0.922 . . . . 61.310000000000002 111.97 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -75.01 -12.69 60.39 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.01 0.433 . . . . 73.420000000000002 110.888 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 79.76 25.18 58.83 Favored Glycine 0 N--CA 1.433 -1.554 0 N-CA-C 112.122 -0.391 . . . . 64.310000000000002 112.122 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -130.66 149.87 74.79 Favored Pre-proline 0 C--N 1.308 -1.207 0 N-CA-C 107.129 -1.434 . . . . 71.019999999999996 107.129 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . 0.507 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 12.3 Cg_endo -57.35 130.48 39.46 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.379 2.053 . . . . 73.409999999999997 111.576 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 16.3 m -81.35 9.07 7.73 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.299 -0.864 . . . . 74.519999999999996 111.033 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 80.6 23.33 60.45 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 109.871 -1.292 . . . . 61.450000000000003 109.871 -176.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -142.13 141.25 32.66 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.508 -1.293 . . . . 70.450000000000003 107.508 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.51 160.29 28.96 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 122.556 0.342 . . . . 53.509999999999998 110.31 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -118.97 144.41 46.5 Favored 'General case' 0 C--N 1.291 -1.974 0 N-CA-C 109.189 -0.671 . . . . 75.219999999999999 109.189 175.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.5 131.52 44.24 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 107.577 -1.268 . . . . 72.150000000000006 107.577 174.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . 0.597 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 33.6 tt0 -104.98 131.94 51.87 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 108.165 -1.05 . . . . 70.510000000000005 108.165 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.64 ' SD ' HD11 ' A' ' 447' ' ' ILE . 67.9 mtp -104.43 178.07 4.67 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 123.008 0.523 . . . . 73.340000000000003 110.241 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -74.3 -36.05 63.72 Favored 'General case' 0 N--CA 1.407 -2.592 0 C-N-CA 123.329 0.652 . . . . 74.349999999999994 111.841 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 69.3 m -144.64 153.66 41.99 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 113.085 0.772 . . . . 63.109999999999999 113.085 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.05 68.77 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.523 1.129 . . . . 55.009999999999998 111.98 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.56 -49.3 77.93 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 115.783 -0.644 . . . . 72.209999999999994 111.62 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.85 -28.7 55.58 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.298 -0.561 . . . . 65.340000000000003 111.552 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.67 -43.57 96.31 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.512 0.507 . . . . 73.099999999999994 109.858 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -69.3 -38.86 78.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.314 0.578 . . . . 75.030000000000001 109.457 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.92 -44.01 97.78 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.285 -0.87 . . . . 42.43 109.622 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.8 97.97 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.877 -0.601 . . . . 35.0 110.6 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -71.58 -22.94 61.66 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 112.079 0.4 . . . . 64.209999999999994 112.079 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -85.72 -42.17 14.48 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.602 -0.518 . . . . 64.329999999999998 109.602 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -70.48 -38.47 74.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.84 -0.618 . . . . 70.040000000000006 109.997 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 56.6 m -107.84 23.8 13.91 Favored 'General case' 0 N--CA 1.421 -1.885 0 CA-C-N 115.831 -0.622 . . . . 62.420000000000002 110.92 -177.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . 0.449 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 29.3 t-80 -64.93 97.25 0.22 Allowed 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.606 -0.887 . . . . 71.209999999999994 108.606 172.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 97.9 mttt 59.32 62.55 1.77 Allowed 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.362 1.065 . . . . 71.319999999999993 110.341 -179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -103.71 134.04 47.69 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 114.919 -1.037 . . . . 71.430000000000007 109.049 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -73.32 133.33 43.83 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 116.013 -0.54 . . . . 61.109999999999999 110.919 -176.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.8 ttt -126.37 104.31 8.11 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 107.95 -1.13 . . . . 70.010000000000005 107.95 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.29 -72.66 0.1 Allowed 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 124.825 1.25 . . . . 75.450000000000003 110.782 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -141.16 -13.12 0.92 Allowed 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 112.754 0.65 . . . . 54.020000000000003 112.754 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . 0.409 ' HD3' ' N ' ' A' ' 517' ' ' TYR . 0.0 OUTLIER -124.92 149.72 47.3 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 108.246 -1.02 . . . . 73.109999999999999 108.246 -174.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . 0.409 ' N ' ' HD3' ' A' ' 516' ' ' ARG . 55.7 m-85 -88.25 128.56 35.47 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 112.714 0.635 . . . . 72.409999999999997 112.714 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 91.2 t -96.2 112.39 28.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.128 -1.396 . . . . 72.230000000000004 107.343 176.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -97.59 114.78 26.77 Favored 'General case' 0 C--N 1.269 -2.892 0 N-CA-C 106.973 -1.492 . . . . 74.510000000000005 106.973 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 78.4 t -104.08 123.71 58.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.883 -0.599 . . . . 73.310000000000002 109.884 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -121.63 147.92 45.23 Favored 'General case' 0 C--O 1.208 -1.116 0 C-N-CA 124.003 0.921 . . . . 73.340000000000003 108.842 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -95.66 152.43 18.46 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.226 0.466 . . . . 73.019999999999996 110.939 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.4 m -152.15 170.71 19.31 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 123.128 0.571 . . . . 73.510000000000005 110.592 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 35.1 t -105.38 156.78 17.85 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 116.212 -0.449 . . . . 63.140000000000001 109.976 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . 0.473 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -57.73 -42.89 84.77 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.217 0.451 . . . . 72.129999999999995 112.217 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.09 -31.49 70.26 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.68 0.753 . . . . 72.439999999999998 109.46 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -72.61 -37.26 68.15 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.999 -1.0 . . . . 51.420000000000002 110.678 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 42.8 ttm -61.44 -44.88 96.33 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.655 -0.868 . . . . 62.399999999999999 108.655 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -62.41 -38.08 88.29 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.797 -1.092 . . . . 72.420000000000002 110.21 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -58.3 -47.89 82.24 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.691 0.796 . . . . 54.420000000000002 109.925 177.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.79 -34.42 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.174 0.511 . . . . 54.43 110.302 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 85.0 mt . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 116.355 -0.384 . . . . 64.349999999999994 111.722 179.089 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 39.0 t . . . . . 0 C--O 1.252 1.211 0 CA-C-O 121.985 0.898 . . . . 71.420000000000002 111.927 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.567 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 98.6 mtt180 -89.5 70.26 7.96 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.099 -0.955 . . . . 74.030000000000001 109.991 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -123.22 18.7 9.9 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.256 -1.338 . . . . 72.140000000000001 110.497 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 63.6 m -113.43 156.82 22.81 Favored 'General case' 0 N--CA 1.417 -2.116 0 C-N-CA 119.682 -0.807 . . . . 75.5 109.424 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -129.18 139.11 52.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 N-CA-C 108.508 -0.923 . . . . 75.310000000000002 108.508 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 -108.2 120.93 43.77 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 107.045 -1.465 . . . . 73.109999999999999 107.045 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.486 HD22 HG22 ' A' ' 520' ' ' VAL . 12.3 mt -100.11 145.54 27.85 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.848 -1.538 . . . . 70.239999999999995 106.848 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -141.15 137.06 32.45 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 109.998 -0.371 . . . . 73.430000000000007 109.998 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 94.41 34.45 6.36 Favored Glycine 0 C--N 1.298 -1.548 0 CA-C-N 115.964 -0.562 . . . . 75.120000000000005 113.047 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 88.1 mt -75.3 150.31 85.03 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 116.881 0.341 . . . . 43.549999999999997 111.159 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.7 156.24 58.61 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 C-N-CA 122.868 2.379 . . . . 61.409999999999997 112.207 176.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -75.31 93.63 2.91 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.029 -1.442 . . . . 75.140000000000001 109.731 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 85.07 38.71 0.02 OUTLIER 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 111.841 -2.436 . . . . 75.140000000000001 111.388 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.24 137.49 57.04 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.205 -1.035 . . . . 74.200000000000003 108.205 169.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 15.4 p -81.5 156.93 25.03 Favored 'General case' 0 N--CA 1.416 -2.156 0 CA-C-N 116.66 -0.246 . . . . 65.209999999999994 110.535 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.464 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 63.3 mt -63.17 -32.52 56.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.746 0.784 . . . . 71.409999999999997 109.202 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -67.27 -36.14 80.97 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.486 -0.779 . . . . 71.209999999999994 110.216 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.08 -35.83 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.185 -0.462 . . . . 63.240000000000002 110.372 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.456 HG22 ' HA ' ' A' ' 458' ' ' ILE . 12.5 tt -73.35 -33.47 40.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 120.443 -0.503 . . . . 71.219999999999999 110.286 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.3 mt -67.71 -35.46 78.83 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.409 0.623 . . . . 72.319999999999993 109.526 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.28 -49.85 74.03 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-N 115.213 -0.903 . . . . 72.299999999999997 109.45 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -51.88 -44.97 63.95 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.025 -1.443 . . . . 74.200000000000003 111.002 177.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.9 -36.56 83.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.388 -0.823 . . . . 73.230000000000004 111.648 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 72.87 -132.17 16.9 Favored Glycine 0 CA--C 1.476 -2.367 0 C-N-CA 120.396 -0.907 . . . . 74.430000000000007 111.246 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -52.32 -36.37 53.11 Favored 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 124.973 1.309 . . . . 72.439999999999998 109.795 176.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -70.33 -5.8 30.57 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.101 -0.954 . . . . 73.219999999999999 112.756 -176.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -72.85 -15.51 61.61 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.421 0.629 . . . . 74.420000000000002 109.769 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 28.5 m -91.06 -16.91 27.1 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 121.748 0.785 . . . . 55.310000000000002 109.263 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . 0.475 ' O ' ' HG3' ' A' ' 495' ' ' MET . 69.2 m-20 -98.26 0.15 45.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.84 -0.618 . . . . 73.25 112.549 -174.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . 0.411 ' HA ' ' HA ' ' A' ' 495' ' ' MET . 14.2 tt -79.06 158.39 4.7 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 N-CA-C 108.378 -0.971 . . . . 74.239999999999995 108.378 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -87.93 157.57 18.91 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.785 -1.191 . . . . 73.329999999999998 107.785 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.2 m -52.19 107.13 0.18 Allowed 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 124.028 0.931 . . . . 74.129999999999995 112.298 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 49.3 m80 61.94 29.08 17.7 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.298 1.039 . . . . 70.439999999999998 111.408 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -78.06 -3.11 84.41 Favored Glycine 0 N--CA 1.439 -1.159 0 CA-C-N 115.63 -0.714 . . . . 73.030000000000001 112.774 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.449 ' HA ' HG13 ' A' ' 493' ' ' ILE . 5.0 p -83.07 103.24 10.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.17 0 CA-C-O 121.507 0.67 . . . . 74.310000000000002 110.686 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -114.99 91.75 3.72 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 116.246 -0.434 . . . . 72.239999999999995 110.116 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . 0.437 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 69.8 mtm -77.54 129.07 35.19 Favored 'General case' 0 CA--C 1.489 -1.392 0 N-CA-C 106.23 -1.767 . . . . 62.439999999999998 106.23 173.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.0 t -81.13 118.39 28.82 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-O 121.47 0.653 . . . . 72.0 110.523 -173.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 69.8 mt -96.59 152.84 18.25 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.451 -1.314 . . . . 72.040000000000006 107.451 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -92.59 -170.44 2.47 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 107.883 -1.154 . . . . 71.140000000000001 107.883 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -72.15 -5.2 33.84 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 124.022 0.929 . . . . 65.099999999999994 113.275 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -109.87 12.07 24.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-O 121.505 0.669 . . . . 53.439999999999998 109.525 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 68.05 31.78 75.69 Favored Glycine 0 CA--C 1.505 -0.558 0 CA-C-N 115.604 -0.725 . . . . 72.109999999999999 112.88 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -121.45 142.21 35.02 Favored Pre-proline 0 C--N 1.305 -1.342 0 N-CA-C 107.0 -1.482 . . . . 74.120000000000005 107.0 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -52.42 129.86 33.63 Favored 'Trans proline' 0 N--CA 1.477 0.53 0 C-N-CA 123.161 2.574 . . . . 72.420000000000002 113.373 -177.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.7 m -77.39 -20.76 54.2 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.859 -0.609 . . . . 53.539999999999999 110.118 178.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 114.58 -18.6 17.32 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.66 -0.7 . . . . 75.5 111.699 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -112.78 164.45 13.37 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 120.929 0.395 . . . . 52.149999999999999 110.244 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.437 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -155.17 160.28 40.78 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.628 -0.714 . . . . 53.539999999999999 109.083 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.52 120.27 25.09 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.518 -1.289 . . . . 74.329999999999998 107.518 174.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . 0.449 HG13 ' HA ' ' A' ' 477' ' ' VAL . 1.7 mp -111.9 132.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.256 0 N-CA-C 108.393 -0.966 . . . . 70.019999999999996 108.393 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -103.45 121.98 43.94 Favored 'General case' 0 C--N 1.258 -3.392 0 N-CA-C 108.022 -1.103 . . . . 71.329999999999998 108.022 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 471' ' ' ASP . 2.0 tpt -92.9 171.45 8.96 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.533 -0.758 . . . . 50.329999999999998 109.987 -173.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -74.57 -36.59 63.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.007 0.923 . . . . 75.200000000000003 109.941 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.2 m -146.51 152.11 38.46 Favored 'General case' 0 N--CA 1.423 -1.819 0 CA-C-N 115.799 -0.637 . . . . 34.409999999999997 109.797 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.62 -36.49 78.73 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.108 0.88 . . . . 72.200000000000003 111.765 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -61.08 -48.82 79.95 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 115.504 -0.771 . . . . 75.430000000000007 110.388 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -68.87 -31.08 69.77 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.556 -1.202 . . . . 74.0 112.294 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.27 -48.29 70.9 Favored 'General case' 0 C--N 1.309 -1.175 0 O-C-N 123.392 0.433 . . . . 73.150000000000006 110.041 175.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -66.88 -38.98 87.32 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 116.053 -0.522 . . . . 74.239999999999995 110.312 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 47.5 tpp -65.81 -41.28 92.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.99 -0.55 . . . . 65.349999999999994 110.532 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.08 77.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 120.902 0.382 . . . . 71.420000000000002 110.401 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.466 ' HA ' HG12 ' A' ' 520' ' ' VAL . . . -71.36 -36.98 71.66 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.864 -0.607 . . . . 73.409999999999997 111.799 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -46.29 68.1 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 107.588 -1.264 . . . . 73.299999999999997 107.588 177.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -62.86 -33.5 75.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.894 -1.048 . . . . 63.439999999999998 110.53 -177.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 61.9 m -116.05 19.66 14.86 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 114.83 1.419 . . . . 65.329999999999998 114.83 -176.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . 0.453 ' CD2' ' HD3' ' A' ' 510' ' ' LYS . 12.8 t60 -68.18 108.77 3.27 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 107.809 -1.182 . . . . 73.430000000000007 107.809 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.453 ' HD3' ' CD2' ' A' ' 509' ' ' HIS . 14.1 mptt 63.73 52.7 2.14 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 122.173 0.987 . . . . 53.210000000000001 110.45 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 21.9 tptm -89.11 139.63 30.27 Favored 'General case' 0 N--CA 1.412 -2.344 0 CA-C-N 114.539 -1.21 . . . . 74.25 109.194 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -76.9 121.93 24.12 Favored 'General case' 0 C--N 1.284 -2.248 0 N-CA-C 108.188 -1.042 . . . . 72.319999999999993 108.188 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -105.84 77.31 1.24 Allowed 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.428 -2.064 . . . . 63.539999999999999 105.428 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? 69.75 -81.94 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.812 -1.54 . . . . 65.510000000000005 110.022 -172.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -125.67 -4.88 7.05 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-O 122.135 0.969 . . . . 61.140000000000001 110.872 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -94.22 160.12 14.83 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.016 -1.476 . . . . 71.230000000000004 107.016 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -120.35 118.27 29.94 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.722 -1.584 . . . . 70.230000000000004 106.722 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 96.0 t -112.79 134.6 54.88 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.996 0 CA-C-O 121.539 0.685 . . . . 72.129999999999995 111.458 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' A' ' 449' ' ' LEU . 32.0 tt0 -95.5 114.31 26.06 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.399 -0.963 . . . . 74.120000000000005 108.399 176.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . 0.486 HG22 HD22 ' A' ' 449' ' ' LEU . 57.3 t -109.39 112.84 42.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 N-CA-C 107.729 -1.211 . . . . 60.32 107.729 176.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -128.31 123.39 33.9 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.218 -0.301 . . . . 64.019999999999996 111.751 -174.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . 0.41 ' OE1' ' HB3' ' A' ' 444' ' ' ARG . 0.6 OUTLIER -70.99 136.0 48.16 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.883 0.373 . . . . 72.200000000000003 110.928 -178.784 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 61.4 m -145.01 170.37 16.29 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 124.39 1.076 . . . . 75.239999999999995 109.307 -177.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.567 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 40.4 t -82.88 154.15 24.76 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.32 -0.622 . . . . 74.299999999999997 109.32 175.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -65.24 -23.57 67.1 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.433 -0.803 . . . . 63.109999999999999 109.489 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.98 -45.3 93.08 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.226 -0.657 . . . . 72.030000000000001 109.226 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -64.32 -40.63 96.29 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.075 0.464 . . . . 71.340000000000003 109.874 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . 0.483 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.9 ttt -60.07 -47.64 85.05 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.361 -0.836 . . . . 63.420000000000002 110.382 178.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.15 -37.92 84.61 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 115.322 -0.854 . . . . 60.509999999999998 110.072 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -63.02 -43.0 99.93 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.255 -0.884 . . . . 75.439999999999998 110.01 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.83 -37.15 72.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 120.776 -0.369 . . . . 71.549999999999997 110.442 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.1 mt . . . . . 0 N--CA 1.467 0.42 0 CA-C-O 120.913 0.387 . . . . 63.240000000000002 111.804 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.424 -1.754 0 N-CA-C 107.199 -1.408 . . . . 63.240000000000002 107.199 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.599 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 95.5 mtt180 -94.01 75.42 4.13 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 122.313 1.054 . . . . 73.329999999999998 108.32 174.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.1 p30 -122.3 10.62 9.95 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 113.39 -1.732 . . . . 74.120000000000005 111.456 -172.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 29.3 m -104.61 141.36 36.57 Favored 'General case' 0 N--CA 1.4 -2.947 0 N-CA-C 108.417 -0.957 . . . . 62.43 108.417 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -123.73 139.11 51.24 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.415 0 N-CA-C 107.766 -1.198 . . . . 60.149999999999999 107.766 -177.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . 0.467 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.4 ttp180 -114.38 123.95 50.74 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 108.948 -0.76 . . . . 71.439999999999998 108.948 175.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.441 ' CD1' HD11 ' A' ' 461' ' ' ILE . 5.6 mt -102.11 138.1 39.5 Favored 'General case' 0 C--N 1.285 -2.235 0 N-CA-C 106.387 -1.709 . . . . 73.219999999999999 106.387 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 63.0 ttp180 -132.38 125.06 29.94 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-O 121.168 0.508 . . . . 62.210000000000001 110.15 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.42 45.69 1.41 Allowed Glycine 0 C--N 1.272 -2.985 0 CA-C-N 115.1 -0.954 . . . . 75.25 111.111 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 92.9 mt -84.19 140.26 39.49 Favored Pre-proline 0 N--CA 1.433 -1.309 0 O-C-N 122.86 -0.2 . . . . 74.040000000000006 110.547 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.55 150.75 33.71 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 123.208 2.606 . . . . 73.349999999999994 112.713 176.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -72.97 103.4 3.75 Favored 'General case' 0 N--CA 1.396 -3.169 0 N-CA-C 107.304 -1.369 . . . . 72.200000000000003 107.304 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 91.94 33.37 0.01 OUTLIER 'General case' 0 C--N 1.279 -2.469 0 CA-C-N 111.254 -2.703 . . . . 65.450000000000003 112.446 175.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -71.44 109.17 5.25 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 107.17 -1.419 . . . . 73.200000000000003 107.17 168.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.7 p -75.23 167.79 21.24 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.71 0.291 . . . . 72.329999999999998 110.791 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 59.7 mt -63.85 -32.49 57.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.983 0.421 . . . . 74.439999999999998 110.392 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.84 -49.75 69.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.306 0.574 . . . . 73.219999999999999 109.563 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 34.1 t70 -67.32 -32.14 72.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.277 -0.874 . . . . 75.319999999999993 111.324 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.517 HG22 ' HA ' ' A' ' 458' ' ' ILE . 11.2 tt -75.94 -30.37 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 109.959 -0.385 . . . . 75.209999999999994 109.959 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.6 mt -68.53 -35.03 76.9 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.25 -0.648 . . . . 73.439999999999998 109.25 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 24.0 t70 -60.04 -51.68 68.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.21 -0.905 . . . . 72.219999999999999 109.242 173.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -55.16 -40.21 70.39 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.204 -1.362 . . . . 64.209999999999994 111.912 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.54 -31.96 73.3 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.982 -0.554 . . . . 75.319999999999993 111.911 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.83 -128.94 15.36 Favored Glycine 0 CA--C 1.474 -2.491 0 C-N-CA 120.447 -0.882 . . . . 54.539999999999999 111.922 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -58.93 -28.37 66.18 Favored 'General case' 0 C--N 1.273 -2.735 0 CA-C-N 113.802 -1.199 . . . . 72.120000000000005 111.698 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -75.74 -5.88 47.88 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 112.454 0.539 . . . . 65.439999999999998 112.454 -178.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.54 63.56 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.309 0.576 . . . . 53.329999999999998 111.422 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 16.4 m -97.85 -6.32 32.77 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 121.371 0.605 . . . . 64.120000000000005 109.971 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . 0.457 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 70.6 m-20 -99.22 -5.73 29.4 Favored 'General case' 0 C--O 1.242 0.69 0 O-C-N 121.94 -0.475 . . . . 44.43 112.2 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . 0.462 ' HA ' ' SD ' ' A' ' 495' ' ' MET . 13.0 tt -69.02 148.48 11.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 CA-C-N 115.273 -0.876 . . . . 71.530000000000001 109.897 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -72.28 173.39 8.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.132 -0.627 . . . . 62.109999999999999 110.499 176.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.9 m -62.05 102.83 0.31 Allowed 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.302 -0.863 . . . . 73.319999999999993 108.973 176.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 58.05 52.8 7.31 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.939 1.295 . . . . 74.0 108.281 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -73.72 -16.42 79.2 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.904 -1.044 . . . . 74.439999999999998 113.439 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.51 121.39 36.66 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-O 121.701 0.762 . . . . 74.319999999999993 111.45 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -132.95 106.84 7.92 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 107.515 -1.291 . . . . 73.349999999999994 107.515 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.9 mtt -88.12 139.57 30.37 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 120.214 -0.595 . . . . 74.430000000000007 110.306 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 61.8 t -83.54 107.19 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.481 -0.933 . . . . 62.409999999999997 108.481 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.7 mt -88.65 154.67 20.12 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 114.436 -1.256 . . . . 75.430000000000007 109.748 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -92.81 160.84 14.76 Favored 'General case' 0 C--N 1.284 -2.261 0 N-CA-C 104.72 -2.326 . . . . 73.420000000000002 104.72 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -64.51 -14.17 56.02 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 119.2 0.909 . . . . 75.540000000000006 112.031 -178.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . 0.404 ' OE1' ' HG3' ' A' ' 486' ' ' ARG . 34.9 tt0 -71.31 -16.72 62.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.414 0.685 . . . . 73.409999999999997 109.99 173.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.52 33.44 22.3 Favored Glycine 0 N--CA 1.435 -1.397 0 CA-C-O 121.941 0.745 . . . . 61.219999999999999 111.285 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.404 ' HG3' ' OE1' ' A' ' 484' ' ' GLN . 4.9 mmp_? -128.61 150.83 75.77 Favored Pre-proline 0 C--N 1.29 -1.98 0 N-CA-C 106.127 -1.805 . . . . 63.530000000000001 106.127 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.39 126.58 18.78 Favored 'Trans proline' 0 C--O 1.247 0.968 0 C-N-CA 121.587 1.524 . . . . 71.140000000000001 111.39 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 20.0 m -67.92 -24.86 65.24 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.605 0.716 . . . . 63.130000000000003 110.198 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 125.86 -20.15 6.44 Favored Glycine 0 N--CA 1.429 -1.784 0 N-CA-C 110.91 -0.876 . . . . 52.420000000000002 110.91 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -111.14 154.44 24.32 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.881 0.372 . . . . 61.109999999999999 110.752 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.59 40.81 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.286 -0.635 . . . . 63.350000000000001 109.286 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . 0.467 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 85.4 m-85 -118.36 137.48 53.08 Favored 'General case' 0 C--N 1.293 -1.871 0 N-CA-C 109.315 -0.624 . . . . 74.209999999999994 109.315 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 52.5 mt -125.3 124.95 68.27 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.202 0 N-CA-C 107.22 -1.4 . . . . 64.310000000000002 107.22 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -102.86 122.93 45.53 Favored 'General case' 0 C--N 1.27 -2.885 0 CA-C-N 115.683 -0.69 . . . . 71.140000000000001 110.247 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 472' ' ' ILE . 26.2 mmt -96.45 169.29 10.01 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 123.691 0.796 . . . . 75.420000000000002 111.608 -176.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -65.32 -32.47 74.14 Favored 'General case' 0 N--CA 1.421 -1.919 0 CA-C-N 115.492 -0.777 . . . . 64.319999999999993 112.737 178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 38.8 p -152.5 163.94 38.57 Favored 'General case' 0 C--O 1.25 1.106 0 CA-C-O 120.587 0.232 . . . . 72.150000000000006 111.389 -177.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.24 85.14 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 123.723 0.809 . . . . 63.409999999999997 111.443 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -54.45 -50.57 67.37 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.406 -0.816 . . . . 73.109999999999999 111.832 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . 0.457 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 2.4 mmp_? -64.53 -42.2 95.91 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 113.846 -1.524 . . . . 75.140000000000001 109.77 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.04 91.17 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.038 -0.983 . . . . 70.040000000000006 110.683 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -64.57 -41.62 96.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.816 -0.629 . . . . 54.32 110.893 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.0 mtp -74.09 -34.61 64.03 Favored 'General case' 0 CA--C 1.508 -0.64 0 C-N-CA 119.625 -0.83 . . . . 63.43 110.85 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.87 -40.4 79.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 116.25 -0.432 . . . . 71.329999999999998 110.09 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.7 -38.72 84.04 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 116.112 -0.494 . . . . 73.549999999999997 111.195 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -67.8 -42.38 81.66 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.497 -0.32 . . . . 74.109999999999999 110.927 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.4 -41.8 75.96 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 120.595 -0.442 . . . . 75.329999999999998 110.819 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 47.9 m -95.93 11.39 34.05 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 113.241 0.83 . . . . 65.310000000000002 113.241 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -66.17 97.6 0.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 O-C-N 121.324 -0.86 . . . . 74.420000000000002 110.861 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.496 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 21.6 ttmm 75.22 33.12 0.72 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.301 1.44 . . . . 71.219999999999999 109.484 175.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -80.59 150.4 29.53 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.462 -1.245 . . . . 73.140000000000001 109.817 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.15 143.56 33.77 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 120.69 0.281 . . . . 75.349999999999994 110.528 177.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.4 ttt -140.37 103.67 4.62 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.927 -1.138 . . . . 74.409999999999997 107.927 175.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp 66.81 -84.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 125.008 1.323 . . . . 63.420000000000002 111.013 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.31 -0.52 2.98 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.919 -0.771 . . . . 65.049999999999997 108.919 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -113.7 160.48 18.59 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.127 -1.064 . . . . 74.120000000000005 108.127 -172.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -113.45 118.85 35.65 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.659 -0.867 . . . . 70.120000000000005 108.659 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.85 112.66 35.73 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 CA-C-O 121.537 0.684 . . . . 64.120000000000005 109.558 -176.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . 0.496 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 42.0 mt-10 -94.49 112.32 24.09 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 107.724 -1.213 . . . . 74.120000000000005 107.724 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.7 t -104.53 127.91 58.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 CA-C-O 121.111 0.481 . . . . 71.409999999999997 111.938 -176.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.78 148.36 48.18 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.502 -0.772 . . . . 72.209999999999994 109.365 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.55 142.06 32.54 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 122.41 0.284 . . . . 65.219999999999999 110.453 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.7 p -147.61 173.68 12.48 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.456 0.646 . . . . 74.25 111.839 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 80.3 p -85.02 158.99 20.31 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.217 -0.901 . . . . 74.400000000000006 110.584 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . 0.552 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -64.67 -29.04 70.04 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.968 -0.56 . . . . 65.319999999999993 110.038 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -73.93 -35.77 64.62 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 116.047 -0.524 . . . . 74.420000000000002 110.313 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -64.42 -47.14 80.27 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.379 -0.971 . . . . 73.120000000000005 108.379 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 23.5 ttt -60.45 -42.98 97.27 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.511 -1.222 . . . . 62.130000000000003 109.969 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -60.72 -45.51 93.99 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.017 -0.992 . . . . 74.430000000000007 109.63 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.59 -40.86 98.03 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.865 0.364 . . . . 74.099999999999994 111.076 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.25 -39.8 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.339 0.59 . . . . 71.040000000000006 110.751 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.317 -0.827 0 N-CA-C 112.649 0.611 . . . . 72.450000000000003 112.649 -176.76 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 23.3 t . . . . . 0 C--O 1.254 1.318 0 CA-C-O 121.19 0.519 . . . . 73.230000000000004 110.584 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.579 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 69.0 ttt180 -83.88 68.23 9.89 Favored 'General case' 0 N--CA 1.41 -2.459 0 N-CA-C 108.806 -0.813 . . . . 74.239999999999995 108.806 174.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -119.66 16.38 12.79 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.229 1.012 . . . . 71.109999999999999 111.064 -178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 39.4 m -112.25 162.52 15.4 Favored 'General case' 0 N--CA 1.414 -2.257 0 N-CA-C 108.376 -0.972 . . . . 74.310000000000002 108.376 -176.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -128.18 138.42 54.73 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 N-CA-C 107.254 -1.387 . . . . 64.510000000000005 107.254 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -111.16 120.16 41.37 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 107.291 -1.374 . . . . 73.420000000000002 107.291 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.552 HD22 HG22 ' A' ' 520' ' ' VAL . 11.1 mt -97.56 139.16 33.88 Favored 'General case' 0 C--N 1.283 -2.314 0 N-CA-C 106.325 -1.731 . . . . 64.340000000000003 106.325 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -138.1 132.32 31.86 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 109.226 -0.657 . . . . 72.230000000000004 109.226 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 102.83 38.56 2.91 Favored Glycine 0 C--N 1.289 -2.073 0 N-CA-C 110.441 -1.064 . . . . 64.040000000000006 110.441 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.82 138.03 96.34 Favored Pre-proline 0 C--O 1.243 0.75 0 CA-C-N 115.434 -0.383 . . . . 70.209999999999994 111.761 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.11 171.93 6.92 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.339 2.693 . . . . 63.229999999999997 113.41 176.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -77.65 99.51 5.82 Favored 'General case' 0 N--CA 1.394 -3.25 0 CA-C-N 113.44 -1.709 . . . . 74.010000000000005 108.959 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 79.57 33.42 0.21 Allowed 'General case' 0 C--N 1.272 -2.778 0 CA-C-N 112.157 -2.292 . . . . 74.310000000000002 112.005 170.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.38 113.31 2.85 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.149 -1.056 . . . . 65.299999999999997 108.149 171.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.6 p -80.12 170.09 16.92 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 116.361 -0.381 . . . . 74.239999999999995 111.336 -175.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.5 pt -61.43 -34.45 61.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 N-CA-C 112.225 0.454 . . . . 73.099999999999994 112.225 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.12 -33.77 63.69 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 119.625 -0.83 . . . . 73.129999999999995 110.66 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.27 -37.71 74.94 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.038 0.447 . . . . 53.520000000000003 110.511 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.472 HG22 ' HA ' ' A' ' 458' ' ' ILE . 14.0 tt -70.65 -37.57 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 116.251 -0.431 . . . . 65.329999999999998 110.22 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 94.5 mt -67.62 -35.24 78.56 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.151 0.5 . . . . 74.099999999999994 110.121 177.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -62.95 -47.79 81.68 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.716 -0.675 . . . . 74.319999999999993 109.25 177.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -56.67 -42.87 79.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.562 -1.199 . . . . 71.420000000000002 110.938 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.77 -29.26 70.49 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.71 -0.677 . . . . 73.140000000000001 111.415 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.65 -121.13 21.41 Favored Glycine 0 CA--C 1.475 -2.468 0 CA-C-O 122.044 0.802 . . . . 63.43 113.088 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -51.75 -41.07 61.31 Favored 'General case' 0 C--N 1.266 -3.058 0 CA-C-N 112.675 -1.762 . . . . 61.420000000000002 111.405 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -82.36 1.87 35.09 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.608 -0.723 . . . . 64.519999999999996 112.52 -172.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -75.54 -15.67 60.35 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-O 121.078 0.466 . . . . 74.25 111.215 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 22.8 m -92.04 -14.47 29.29 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.342 0.592 . . . . 73.209999999999994 110.327 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . 0.455 ' CB ' ' HG2' ' A' ' 500' ' ' ARG . 2.9 m-20 -100.27 3.21 43.35 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 116.102 -0.499 . . . . 73.340000000000003 112.295 -176.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.6 tt -73.31 148.79 8.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 N-CA-C 108.26 -1.015 . . . . 63.329999999999998 108.26 176.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . 0.409 ' O ' HG12 ' A' ' 472' ' ' ILE . 71.8 mtp180 -79.21 156.99 27.92 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.95 -1.13 . . . . 71.299999999999997 107.95 174.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 2.0 p -61.15 110.82 1.49 Allowed 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 112.487 0.551 . . . . 71.329999999999998 112.487 -178.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 63.21 35.26 12.78 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.664 1.186 . . . . 61.43 108.899 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.85 -10.52 83.62 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 114.854 -1.066 . . . . 71.299999999999997 111.202 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.2 p -81.21 105.07 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-O 122.162 0.982 . . . . 55.299999999999997 110.654 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -113.11 98.85 7.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.05 -0.977 . . . . 74.209999999999994 109.809 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 67.8 mtm -82.15 130.99 35.23 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.995 -1.113 . . . . 55.219999999999999 107.995 177.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . 0.518 ' O ' ' HA ' ' A' ' 487' ' ' PRO . 52.3 t -82.98 122.14 36.99 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 107.378 -1.342 . . . . 64.219999999999999 107.378 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.9 mt -99.99 154.9 18.02 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.226 0.536 . . . . 54.030000000000001 110.948 -175.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -102.72 175.66 5.42 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 105.417 -2.068 . . . . 64.25 105.417 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -60.0 -24.91 64.84 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.389 0.541 . . . . 72.349999999999994 110.713 -178.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . 0.48 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 8.6 tt0 -68.29 -17.24 64.23 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 123.684 0.794 . . . . 73.310000000000002 111.095 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.24 28.9 35.18 Favored Glycine 0 N--CA 1.441 -1.002 0 CA-C-N 116.151 -0.477 . . . . 65.030000000000001 112.168 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.48 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 96.3 mtt180 -131.98 153.63 81.44 Favored Pre-proline 0 C--N 1.302 -1.474 0 N-CA-C 107.734 -1.21 . . . . 73.239999999999995 107.734 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . 0.518 ' HA ' ' O ' ' A' ' 480' ' ' VAL . 11.5 Cg_endo -56.32 133.25 56.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.514 2.143 . . . . 64.420000000000002 111.509 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 22.5 m -64.87 -12.57 50.21 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 123.751 0.82 . . . . 73.420000000000002 111.334 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 123.73 -12.72 8.24 Favored Glycine 0 CA--C 1.48 -2.108 0 N-CA-C 110.685 -0.966 . . . . 71.230000000000004 110.685 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . 0.412 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.6 p-10 -124.74 156.21 38.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-O 121.104 0.478 . . . . 72.239999999999995 110.601 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.5 150.79 29.97 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.195 -0.911 . . . . 70.109999999999999 108.751 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -112.04 127.87 56.02 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 108.906 -0.776 . . . . 75.140000000000001 108.906 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.54 128.75 73.8 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 107.921 -1.14 . . . . 73.409999999999997 107.921 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -104.29 124.36 49.03 Favored 'General case' 0 C--N 1.276 -2.589 0 CA-C-N 115.99 -0.55 . . . . 74.319999999999993 110.834 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -93.88 170.65 9.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.495 -0.775 . . . . 74.010000000000005 111.171 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -69.48 -28.54 66.16 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.87 -1.059 . . . . 73.019999999999996 110.097 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.5 m -154.42 151.16 28.66 Favored 'General case' 0 C--O 1.253 1.261 0 N-CA-C 109.332 -0.618 . . . . 74.310000000000002 109.332 -175.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.42 -25.71 68.1 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.119 0.968 . . . . 65.5 112.847 -177.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . 0.432 ' HB2' ' HD2' ' A' ' 500' ' ' ARG . 3.3 m-20 -54.69 -51.65 64.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.811 0.815 . . . . 74.530000000000001 110.083 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . 0.455 ' HG2' ' CB ' ' A' ' 471' ' ' ASP . 10.1 mpt_? -65.88 -38.0 87.64 Favored 'General case' 0 CA--C 1.496 -1.127 0 CA-C-N 114.426 -1.261 . . . . 74.230000000000004 110.381 -176.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.44 88.91 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.45 -0.795 . . . . 54.219999999999999 110.84 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . 0.412 ' HA ' ' HG3' ' A' ' 522' ' ' GLN . 66.2 t80 -68.66 -40.87 80.0 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.23 0.538 . . . . 61.420000000000002 110.177 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 66.6 mtt -70.31 -38.08 74.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.78 -0.646 . . . . 74.030000000000001 110.79 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.47 -41.98 83.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.305 -0.407 . . . . 64.209999999999994 110.37 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.46 ' HA ' HG12 ' A' ' 520' ' ' VAL . . . -67.41 -38.15 84.17 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 116.365 -0.38 . . . . 71.140000000000001 110.827 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -70.39 -39.51 74.47 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.747 -0.381 . . . . 73.209999999999994 111.1 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.57 -28.49 56.26 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.014 0.435 . . . . 74.420000000000002 111.128 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 39.7 m -114.99 18.56 16.31 Favored 'General case' 0 C--O 1.254 1.294 0 N-CA-C 113.13 0.789 . . . . 73.049999999999997 113.13 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -68.51 106.6 2.61 Favored 'General case' 0 C--O 1.243 0.715 0 O-C-N 121.052 -1.03 . . . . 73.219999999999999 109.868 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 81.3 tttt 72.53 29.8 2.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.833 1.253 . . . . 61.229999999999997 109.831 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.08 146.81 35.01 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.725 -1.125 . . . . 72.120000000000005 109.123 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 517' ' ' TYR . 9.0 p30 -87.28 137.28 32.47 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 120.525 -0.47 . . . . 43.5 111.171 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.5 ttt -125.42 91.65 3.46 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.511 -1.292 . . . . 74.040000000000006 107.511 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.6 -86.75 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.764 -1.107 . . . . 74.209999999999994 112.505 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.37 -27.16 13.61 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 113.424 0.898 . . . . 63.530000000000001 113.424 -172.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -130.6 157.84 41.63 Favored 'General case' 0 C--N 1.274 -2.69 0 CA-C-N 115.854 -0.612 . . . . 72.239999999999995 110.836 -167.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 512' ' ' ASN . 97.6 m-85 -95.56 125.85 40.44 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.152 -0.684 . . . . 75.510000000000005 109.152 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 66.7 t -106.92 117.24 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.543 0 CA-C-N 114.994 -1.003 . . . . 74.329999999999998 109.764 -175.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -81.7 110.6 17.19 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 107.125 -1.435 . . . . 52.140000000000001 107.125 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . 0.552 HG22 HD22 ' A' ' 449' ' ' LEU . 75.4 t -103.57 107.65 22.7 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 107.388 -1.338 . . . . 71.239999999999995 107.388 177.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -116.43 144.25 44.54 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.965 -0.754 . . . . 63.200000000000003 108.965 -175.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . 0.412 ' HG3' ' HA ' ' A' ' 502' ' ' PHE . 0.2 OUTLIER -89.04 123.8 33.68 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.769 -1.197 . . . . 55.100000000000001 107.769 -175.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 88.7 m -132.37 174.07 10.63 Favored 'General case' 0 C--N 1.283 -2.31 0 N-CA-C 113.434 0.902 . . . . 64.219999999999999 113.434 -169.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.579 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.0 t -103.6 154.09 19.88 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.096 -0.956 . . . . 72.530000000000001 111.779 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -69.49 -17.26 63.59 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.285 -0.871 . . . . 72.409999999999997 109.853 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.42 -46.28 33.68 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.875 -0.602 . . . . 72.310000000000002 109.725 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 524' ' ' SER . 13.5 pt-20 -71.57 -28.64 63.98 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.867 -0.79 . . . . 74.430000000000007 108.867 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . 0.578 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.4 ttt -59.27 -51.64 69.07 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.392 -0.822 . . . . 75.239999999999995 109.213 174.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.92 -35.92 82.26 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.435 -0.802 . . . . 70.310000000000002 110.144 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.98 -47.79 83.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.533 -0.758 . . . . 71.430000000000007 110.583 175.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.15 -35.72 72.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.46 -0.336 . . . . 71.409999999999997 110.889 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 528' ' ' MET . 77.4 mt . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 121.165 0.507 . . . . 73.430000000000007 110.018 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 C--O 1.248 0.988 0 CA-C-O 121.265 0.555 . . . . 74.409999999999997 110.894 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.599 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 8.0 ptp180 -83.89 65.35 8.58 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 122.024 0.916 . . . . 72.310000000000002 112.062 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -103.34 6.23 37.77 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.118 -0.946 . . . . 75.140000000000001 111.225 -178.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 38.4 m -107.91 155.08 20.69 Favored 'General case' 0 N--CA 1.415 -2.185 0 N-CA-C 108.852 -0.795 . . . . 52.140000000000001 108.852 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -132.57 141.18 45.8 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.379 0 N-CA-C 106.99 -1.485 . . . . 73.349999999999994 106.99 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . 0.467 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.5 ttp180 -116.24 123.61 48.15 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.863 -0.792 . . . . 74.239999999999995 108.863 173.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.458 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 1.6 mt -97.5 135.14 39.78 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 105.82 -1.919 . . . . 75.430000000000007 105.82 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -136.39 135.0 38.41 Favored 'General case' 0 C--N 1.287 -2.126 0 C-N-CA 119.771 -0.772 . . . . 50.329999999999998 110.889 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 107.11 23.97 6.78 Favored Glycine 0 N--CA 1.432 -1.627 0 N-CA-C 110.399 -1.081 . . . . 52.009999999999998 110.399 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.72 144.61 97.88 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 112.965 0.728 . . . . 73.030000000000001 112.965 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -55.19 149.54 44.25 Favored 'Trans proline' 0 CA--C 1.492 -1.591 0 C-N-CA 123.107 2.538 . . . . 63.009999999999998 112.182 175.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -77.34 106.63 9.21 Favored 'General case' 1 N--CA 1.37 -4.465 0 N-CA-C 106.123 -1.806 . . . . 63.240000000000002 106.123 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 92.52 31.19 0.01 OUTLIER 'General case' 0 C--N 1.282 -2.343 0 CA-C-N 111.299 -2.682 . . . . 62.43 112.469 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.7 117.32 12.07 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.269 -1.382 . . . . 75.430000000000007 107.269 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.0 p -88.25 173.94 8.49 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.063 0.459 . . . . 65.310000000000002 111.722 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.505 ' HA ' HG22 ' A' ' 461' ' ' ILE . 2.5 pp -64.02 -18.55 22.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.55 0.69 . . . . 72.109999999999999 111.881 175.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -79.85 -40.43 28.45 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 109.221 -0.659 . . . . 72.219999999999999 109.221 175.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.3 -43.58 94.28 Favored 'General case' 0 CA--C 1.497 -1.069 0 CA-C-N 115.859 -0.61 . . . . 53.009999999999998 110.731 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.505 HG22 ' HA ' ' A' ' 458' ' ' ILE . 15.9 tt -68.93 -32.83 56.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.572 -0.74 . . . . 74.25 111.173 -176.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.448 HD23 ' O ' ' A' ' 458' ' ' ILE . 3.9 mm? -74.54 -36.3 63.14 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.79 0.328 . . . . 64.209999999999994 110.679 176.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.13 -47.97 82.19 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 108.789 -0.819 . . . . 74.120000000000005 108.789 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -52.56 -42.06 64.11 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 113.461 -1.699 . . . . 73.109999999999999 111.37 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 493' ' ' ILE . 83.0 mt -63.63 -37.17 86.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.924 -0.58 . . . . 60.219999999999999 112.391 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.36 -130.33 18.4 Favored Glycine 0 CA--C 1.484 -1.844 0 C-N-CA 119.773 -1.203 . . . . 62.420000000000002 111.765 -177.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.92 -26.67 66.12 Favored 'General case' 0 C--N 1.274 -2.689 0 C-N-CA 124.463 1.105 . . . . 74.519999999999996 112.093 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -71.38 -11.73 61.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 73.430000000000007 111.511 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.36 -15.54 62.87 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.16 -0.473 . . . . 51.009999999999998 111.48 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.2 m -78.2 -28.05 47.95 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-O 121.099 0.476 . . . . 74.150000000000006 110.253 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -100.46 10.8 40.7 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.623 0.725 . . . . 74.109999999999999 111.507 -172.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 13.4 tt -67.94 142.92 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 N-CA-C 109.504 -0.554 . . . . 74.239999999999995 109.504 178.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 495' ' ' MET . 1.6 tpt180 -66.67 155.8 36.98 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.898 -1.149 . . . . 53.329999999999998 107.898 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 86.9 m -64.46 106.66 1.18 Allowed 'General case' 0 C--N 1.296 -1.744 0 O-C-N 123.403 0.439 . . . . 74.430000000000007 109.995 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 12.2 m170 64.2 27.78 13.96 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.988 0.915 . . . . 74.450000000000003 109.859 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.5 -19.32 70.74 Favored Glycine 0 C--N 1.337 0.621 0 CA-C-N 114.955 -1.021 . . . . 60.140000000000001 114.055 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.4 p -76.2 118.88 23.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-O 121.455 0.645 . . . . 63.509999999999998 110.403 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -134.07 111.49 10.4 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.809 -0.811 . . . . 74.209999999999994 108.809 -178.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 76.4 mtp -88.31 139.57 30.35 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.727 -0.789 . . . . 73.230000000000004 109.311 179.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.0 t -83.71 100.96 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 108.27 -1.011 . . . . 73.209999999999994 108.27 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.45 146.82 23.84 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.69 -1.226 . . . . 75.209999999999994 107.69 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -89.17 -172.97 3.86 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 108.304 -0.999 . . . . 64.400000000000006 108.304 -176.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -63.61 -26.83 68.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.104 0.478 . . . . 61.530000000000001 111.048 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -74.87 -7.21 52.82 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-O 121.482 0.658 . . . . 73.150000000000006 110.763 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.0 30.9 62.55 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.793 -0.523 . . . . 71.239999999999995 111.793 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -131.06 150.75 77.46 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 106.993 -1.484 . . . . 73.109999999999999 106.993 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.42 125.04 17.56 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 122.968 2.445 . . . . 53.450000000000003 114.2 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 38.4 m -69.31 -28.62 66.42 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.276 -0.875 . . . . 70.420000000000002 110.246 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 133.41 -21.07 4.1 Favored Glycine 0 CA--C 1.493 -1.307 0 CA-C-N 115.59 -0.732 . . . . 52.439999999999998 111.526 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . 0.458 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 20.3 p-10 -110.72 151.87 27.23 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.336 0.589 . . . . 64.219999999999999 111.302 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.77 155.27 36.86 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.662 -0.866 . . . . 64.219999999999999 108.662 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . 0.467 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 77.6 m-85 -111.48 142.11 44.18 Favored 'General case' 0 C--N 1.284 -2.255 0 CA-C-O 121.063 0.459 . . . . 73.530000000000001 110.456 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 465' ' ' LEU . 67.8 mt -126.8 139.72 51.02 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 105.399 -2.074 . . . . 62.450000000000003 105.399 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -121.16 136.16 55.03 Favored 'General case' 0 C--N 1.274 -2.715 0 C-N-CA 119.905 -0.718 . . . . 64.400000000000006 109.443 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.402 ' O ' ' HD3' ' A' ' 473' ' ' ARG . 0.2 OUTLIER -103.9 173.7 6.19 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 123.686 0.616 . . . . 72.040000000000006 110.242 176.401 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -70.26 -42.08 72.62 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-O 121.197 0.522 . . . . 73.219999999999999 110.103 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 500' ' ' ARG . 36.6 t -130.38 156.82 44.08 Favored 'General case' 0 N--CA 1.412 -2.331 0 CA-C-N 115.587 -0.733 . . . . 61.149999999999999 111.141 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.45 -28.36 66.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.79 -1.095 . . . . 75.420000000000002 111.262 -177.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.21 -47.82 84.35 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 116.185 -0.461 . . . . 75.540000000000006 111.434 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 497' ' ' SER . 0.5 OUTLIER -74.18 -32.75 63.2 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.031 -0.668 . . . . 74.120000000000005 111.076 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.34 96.34 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 123.447 0.467 . . . . 73.540000000000006 110.352 177.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -65.65 -42.6 91.24 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.869 -0.605 . . . . 74.310000000000002 110.038 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 16.0 tpt -67.91 -37.62 81.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.01 -0.541 . . . . 65.420000000000002 110.508 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.62 92.8 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.322 -0.399 . . . . 73.049999999999997 109.98 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.84 -38.71 86.93 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-O 120.72 0.295 . . . . 72.200000000000003 111.022 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -67.32 -41.38 85.38 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.831 0.348 . . . . 60.25 110.583 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -68.38 -39.59 81.69 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.869 -0.605 . . . . 54.039999999999999 110.79 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . 0.6 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 49.1 m -99.35 14.22 30.45 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 113.187 0.81 . . . . 71.129999999999995 113.187 -175.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -64.83 105.01 0.92 Allowed 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.013 -0.736 . . . . 64.340000000000003 109.013 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt 69.9 20.5 6.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.613 1.165 . . . . 61.530000000000001 111.648 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . 0.6 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 26.5 tptp -70.83 142.17 51.29 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 124.073 0.949 . . . . 71.299999999999997 109.076 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -97.97 143.28 28.71 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 119.319 -0.952 . . . . 62.109999999999999 110.848 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 44.3 ttm -111.16 114.32 27.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 104.544 -2.391 . . . . 72.129999999999995 104.544 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 97.4 mttt 67.16 -85.42 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.344 1.027 . . . . 64.409999999999997 109.011 -172.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -137.73 -8.89 1.63 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.466 0.65 . . . . 75.439999999999998 111.043 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -92.3 135.17 34.24 Favored 'General case' 0 CA--C 1.485 -1.524 0 N-CA-C 109.0 -0.741 . . . . 74.400000000000006 109.0 -175.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -87.01 132.25 33.85 Favored 'General case' 0 C--N 1.259 -3.335 0 CA-C-N 115.586 -0.734 . . . . 74.319999999999993 109.678 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 57.6 t -122.43 127.3 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 N-CA-C 108.727 -0.842 . . . . 70.519999999999996 108.727 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -93.68 115.6 28.06 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.742 -1.207 . . . . 73.340000000000003 107.742 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . 0.422 HG22 HD22 ' A' ' 449' ' ' LEU . 94.3 t -104.34 127.06 58.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 CA-C-N 116.392 -0.367 . . . . 62.020000000000003 110.93 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -131.53 150.91 51.98 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.008 -0.542 . . . . 75.329999999999998 110.766 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -82.7 156.63 23.69 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.168 0.587 . . . . 62.049999999999997 110.098 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 66.0 m -157.23 166.56 32.82 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 122.966 0.506 . . . . 74.140000000000001 110.163 -176.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 58.5 p -97.06 155.28 16.87 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.916 -0.584 . . . . 65.310000000000002 110.32 177.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.45 62.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.127 -0.488 . . . . 53.119999999999997 111.688 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.99 -45.91 66.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.575 -0.528 . . . . 74.549999999999997 109.575 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.06 -41.7 97.26 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.418 0.628 . . . . 74.129999999999995 109.58 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -60.39 -44.41 95.69 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.788 -1.096 . . . . 73.310000000000002 110.81 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.13 -40.74 78.09 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.657 -0.498 . . . . 71.0 109.657 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.3 -41.94 97.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.903 -0.59 . . . . 72.120000000000005 110.986 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 96.0 t -72.6 -35.85 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 120.71 -0.396 . . . . 74.349999999999994 110.766 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 78.6 mt . . . . . 0 C--N 1.323 -0.583 0 CA-C-O 121.302 0.573 . . . . 71.340000000000003 111.399 179.547 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 52.5 t . . . . . 0 C--O 1.245 0.858 0 N-CA-C 108.674 -0.862 . . . . 63.340000000000003 108.674 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.601 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 32.3 mtp180 -93.67 67.82 3.92 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 119.645 -0.822 . . . . 73.099999999999994 109.353 178.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -99.2 12.54 35.88 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.589 -0.732 . . . . 73.099999999999994 110.966 -175.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 27.8 m -117.03 149.5 40.18 Favored 'General case' 0 N--CA 1.412 -2.325 0 N-CA-C 108.646 -0.872 . . . . 63.310000000000002 108.646 -178.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . 0.723 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.3 mt -126.96 151.03 33.33 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.76 0 N-CA-C 107.056 -1.461 . . . . 53.020000000000003 107.056 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -125.36 124.81 42.35 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.808 -1.182 . . . . 73.109999999999999 107.808 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 15.2 mt -100.78 142.66 31.94 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 107.117 -1.438 . . . . 73.140000000000001 107.117 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -144.3 126.99 16.14 Favored 'General case' 0 C--N 1.284 -2.263 0 CA-C-O 121.849 0.833 . . . . 74.409999999999997 110.669 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 108.63 32.75 3.05 Favored Glycine 0 C--N 1.279 -2.637 0 CA-C-N 114.754 -1.112 . . . . 61.43 110.781 -177.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 95.4 mt -59.98 140.93 90.23 Favored Pre-proline 0 C--O 1.241 0.616 0 N-CA-C 112.07 0.396 . . . . 73.140000000000001 112.07 -179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 452' ' ' LEU . 27.4 Cg_exo -61.08 170.57 4.75 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.104 2.536 . . . . 63.539999999999999 113.874 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.95 93.13 4.38 Favored 'General case' 0 N--CA 1.403 -2.785 0 CA-C-N 113.573 -1.649 . . . . 72.329999999999998 109.694 178.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 83.06 28.89 0.09 Allowed 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 113.007 -1.906 . . . . 70.030000000000001 112.695 171.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -61.4 132.67 54.25 Favored 'General case' 0 C--O 1.246 0.907 0 N-CA-C 108.686 -0.857 . . . . 65.530000000000001 108.686 173.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 73.1 p -95.97 176.52 6.08 Favored 'General case' 0 N--CA 1.418 -2.028 0 CA-C-O 121.695 0.759 . . . . 74.409999999999997 112.362 -174.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 31.9 pt -65.02 -26.32 39.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.06 0 CA-C-N 115.071 -0.968 . . . . 74.019999999999996 111.536 176.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -76.85 -32.29 57.43 Favored 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 119.473 -0.891 . . . . 74.450000000000003 110.19 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.84 -42.35 99.71 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.984 -0.553 . . . . 72.120000000000005 110.15 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.402 HG22 ' O ' ' A' ' 458' ' ' ILE . 11.8 tt -69.03 -36.03 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 120.606 -0.437 . . . . 71.450000000000003 110.666 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 97.6 mt -67.49 -38.99 85.19 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 120.951 0.405 . . . . 73.230000000000004 110.246 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -62.51 -51.3 67.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.464 -0.789 . . . . 63.5 109.327 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 94.4 t80 -55.94 -39.4 71.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 113.912 -1.495 . . . . 75.340000000000003 111.42 -178.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 71.5 mt -71.31 -32.78 69.02 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.765 -0.652 . . . . 63.210000000000001 112.666 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 73.28 -134.06 19.07 Favored Glycine 0 CA--C 1.48 -2.101 0 C-N-CA 119.252 -1.452 . . . . 51.109999999999999 111.244 -178.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -64.55 -21.57 66.73 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-N 114.629 -0.785 . . . . 53.149999999999999 111.158 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -67.08 -14.18 62.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.277 0.56 . . . . 74.329999999999998 110.535 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . 0.429 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -71.27 -14.84 62.36 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.025 -0.534 . . . . 63.219999999999999 111.151 177.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 27.7 m -84.17 -23.98 30.37 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-O 121.776 0.798 . . . . 72.010000000000005 109.028 176.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -90.92 -11.27 39.62 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.44 -0.8 . . . . 72.340000000000003 111.999 -175.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 469' ' ' ALA . 9.5 tt -77.17 132.92 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 N-CA-C 108.868 -0.79 . . . . 52.530000000000001 108.868 176.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 -72.71 159.34 33.97 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.942 -0.392 . . . . 71.099999999999994 109.942 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 72.1 m -57.18 113.1 1.58 Allowed 'General case' 0 C--O 1.246 0.92 0 CA-C-O 121.286 0.565 . . . . 75.319999999999993 111.761 -174.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 62.82 37.35 12.38 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 114.329 -1.305 . . . . 75.120000000000005 108.764 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -70.46 -14.29 71.84 Favored Glycine 0 N--CA 1.436 -1.356 0 CA-C-N 115.062 -0.972 . . . . 62.149999999999999 111.707 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 492' ' ' PHE . 4.2 p -83.38 101.85 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.87 0 CA-C-O 122.089 0.947 . . . . 74.310000000000002 110.588 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -107.78 101.87 11.13 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.45 -0.944 . . . . 75.450000000000003 108.45 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . 0.511 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 46.5 ttm -80.59 137.09 36.35 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 120.908 0.385 . . . . 51.399999999999999 110.95 -177.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 59.5 t -90.36 111.46 23.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 CA-C-N 115.682 -0.69 . . . . 44.009999999999998 110.529 -177.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 2.2 pp -92.91 156.9 16.65 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.289 -0.868 . . . . 51.439999999999998 110.415 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -97.21 -169.03 1.79 Allowed 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.891 -1.522 . . . . 63.020000000000003 106.891 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -60.02 -30.17 68.99 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 123.342 0.657 . . . . 70.439999999999998 111.49 -178.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -73.63 -17.83 61.11 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.039 0.447 . . . . 73.420000000000002 110.891 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 89.77 19.41 47.98 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.481 -0.866 . . . . 71.5 111.884 -177.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.456 ' HD3' ' O ' ' A' ' 487' ' ' PRO . 0.1 OUTLIER -118.85 146.7 40.71 Favored Pre-proline 0 N--CA 1.445 -0.676 0 N-CA-C 107.211 -1.403 . . . . 75.510000000000005 107.211 179.252 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . 0.511 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 10.2 Cg_endo -53.39 133.2 52.15 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 C-N-CA 123.325 2.684 . . . . 75.340000000000003 113.265 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 21.1 m -80.02 0.02 33.54 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.674 0.75 . . . . 74.340000000000003 109.509 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 94.02 2.07 64.73 Favored Glycine 0 N--CA 1.426 -1.998 0 N-CA-C 110.411 -1.076 . . . . 53.520000000000003 110.411 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . 0.503 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 18.0 t70 -114.61 146.19 41.11 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.313 -1.366 . . . . 74.040000000000006 107.313 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -160.17 162.59 33.92 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 109.619 -0.512 . . . . 64.409999999999997 109.619 -177.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 87.3 m-85 -115.73 145.87 42.4 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 120.646 0.26 . . . . 71.150000000000006 110.558 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.1 mt -118.07 134.88 60.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 105.988 -1.856 . . . . 74.439999999999998 105.988 172.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -118.72 109.66 16.35 Favored 'General case' 0 C--N 1.27 -2.861 0 N-CA-C 109.414 -0.587 . . . . 73.120000000000005 109.414 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.723 ' SD ' HD11 ' A' ' 447' ' ' ILE . 71.8 mtp -104.11 169.15 8.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.957 -0.565 . . . . 74.349999999999994 111.043 -175.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.22 -53.13 60.76 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 123.441 0.697 . . . . 74.0 111.775 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -121.2 146.04 47.2 Favored 'General case' 0 N--CA 1.419 -2.009 0 CA-C-N 115.669 -0.696 . . . . 64.340000000000003 112.142 -169.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.96 66.57 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-N 114.949 -1.023 . . . . 72.310000000000002 109.997 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -68.17 -46.91 69.45 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 122.103 0.954 . . . . 74.420000000000002 109.339 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -68.71 -38.78 80.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 114.02 -1.446 . . . . 75.040000000000006 109.274 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.14 -38.32 87.85 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.33 -0.85 . . . . 73.129999999999995 110.603 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -64.27 -42.54 96.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.585 -0.524 . . . . 73.430000000000007 109.585 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.3 mtp -61.88 -43.41 98.91 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.389 -0.369 . . . . 71.439999999999998 110.244 178.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.3 96.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.494 -0.775 . . . . 73.010000000000005 110.7 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.11 -30.28 67.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.969 0.414 . . . . 43.32 111.382 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -46.56 64.01 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.866 -0.606 . . . . 64.530000000000001 110.247 176.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . 0.577 ' HE3' ' HA ' ' A' ' 507' ' ' LYS . 1.4 tpmt? -75.7 -31.99 59.92 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.085 0.469 . . . . 73.409999999999997 110.582 -175.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 44.1 m -96.41 9.14 42.2 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 120.967 0.413 . . . . 65.409999999999997 111.918 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -63.47 101.85 0.37 Allowed 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.294 -0.632 . . . . 73.120000000000005 109.294 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 54.54 66.52 1.21 Allowed 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.532 1.533 . . . . 71.099999999999994 110.138 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -97.11 141.89 29.71 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 113.634 -1.621 . . . . 51.020000000000003 109.49 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.424 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 0.8 OUTLIER -92.72 116.53 29.1 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 108.214 -1.032 . . . . 71.409999999999997 108.214 175.115 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.0 ttt -103.6 103.91 13.91 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 107.336 -1.357 . . . . 71.230000000000004 107.336 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 89.0 mttt 67.57 -77.91 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.372 1.069 . . . . 75.439999999999998 109.791 -175.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -135.4 -12.17 2.11 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 123.444 0.697 . . . . 60.219999999999999 110.926 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . 0.424 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 28.2 tpt180 -88.83 152.75 21.57 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.035 -0.53 . . . . 72.140000000000001 109.723 -172.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.82 118.21 36.02 Favored 'General case' 0 C--N 1.291 -1.96 0 N-CA-C 107.356 -1.35 . . . . 72.439999999999998 107.356 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 60.0 t -114.5 116.98 54.2 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 109.046 -0.724 . . . . 53.240000000000002 109.046 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -95.95 110.87 23.01 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.604 -0.887 . . . . 63.310000000000002 108.604 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.51 135.21 44.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-N 115.999 -0.546 . . . . 62.009999999999998 111.868 -177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -126.35 162.22 26.02 Favored 'General case' 0 C--O 1.215 -0.728 0 C-N-CA 124.35 1.06 . . . . 72.129999999999995 109.19 176.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -100.71 157.61 16.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.815 -0.809 . . . . 73.239999999999995 108.815 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -156.68 163.43 39.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-O 121.892 0.853 . . . . 65.219999999999999 111.501 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 3.6 m -97.74 158.81 15.3 Favored 'General case' 0 C--N 1.271 -2.839 0 CA-C-N 114.722 -1.126 . . . . 63.509999999999998 108.555 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -57.24 -33.88 68.02 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 122.019 0.914 . . . . 72.230000000000004 108.869 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.4 -41.34 98.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.375 -1.284 . . . . 64.430000000000007 110.29 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . 0.434 ' O ' HG23 ' A' ' 531' ' ' VAL . 38.3 mt-10 -69.95 -36.53 75.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.213 -0.448 . . . . 73.450000000000003 110.095 178.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 46.2 ttm -63.7 -43.7 95.84 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.162 -0.681 . . . . 63.0 109.162 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -61.55 -40.28 94.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.212 -0.904 . . . . 74.140000000000001 109.593 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -63.69 -41.3 98.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.994 -0.548 . . . . 63.229999999999997 110.643 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 527' ' ' GLU . 98.9 t -65.35 -31.44 53.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.143 0.497 . . . . 63.219999999999999 110.499 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.304 -1.39 0 CA-C-O 121.317 0.579 . . . . 73.439999999999998 111.126 175.638 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.434 -1.265 0 N-CA-C 106.377 -1.712 . . . . 71.5 106.377 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.595 ' HA ' ' HA ' ' A' ' 524' ' ' SER 0.258 9.4 ptm85 -92.98 73.95 4.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 114.51 1.3 . . . . 72.230000000000004 114.51 -176.265 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.66 9.27 17.8 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.097 -0.956 . . . . 52.450000000000003 108.898 177.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 17.2 m -107.53 143.88 35.31 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 115.507 -0.769 . . . . 73.099999999999994 108.926 -176.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . 0.45 HD11 ' SD ' ' A' ' 495' ' ' MET . 3.2 mt -120.95 148.49 24.17 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.79 0 C-N-CA 123.758 0.823 . . . . 71.329999999999998 110.09 -176.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -126.58 122.52 35.3 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 107.254 -1.388 . . . . 74.150000000000006 107.254 176.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.595 HD22 HG22 ' A' ' 520' ' ' VAL . 27.5 mt -108.55 153.71 22.98 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.267 -0.642 . . . . 64.430000000000007 109.267 -175.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . 0.426 ' HD2' ' OE2' ' A' ' 519' ' ' GLU . 32.6 ttm180 -142.15 147.56 36.85 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 107.402 -1.332 . . . . 61.399999999999999 107.402 172.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 86.24 34.61 12.08 Favored Glycine 0 C--N 1.306 -1.124 0 C-N-CA 120.304 -0.95 . . . . 61.530000000000001 114.045 175.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 86.4 mt -82.3 142.34 47.01 Favored Pre-proline 0 C--N 1.302 -1.476 0 N-CA-C 109.015 -0.735 . . . . 74.420000000000002 109.015 174.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.58 163.74 2.56 Favored 'Trans proline' 0 C--O 1.252 1.221 0 C-N-CA 123.126 2.551 . . . . 75.530000000000001 112.721 176.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -71.95 93.48 1.36 Allowed 'General case' 0 N--CA 1.412 -2.35 0 CA-C-N 114.538 -1.21 . . . . 74.329999999999998 110.094 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 78.66 36.46 0.19 Allowed 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 112.105 -2.316 . . . . 53.329999999999998 111.815 171.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -57.51 130.95 48.63 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.924 -1.139 . . . . 62.020000000000003 107.924 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.89 164.63 26.35 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-O 120.827 0.346 . . . . 41.549999999999997 110.439 -173.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.443 ' O ' HG22 ' A' ' 461' ' ' ILE . 61.0 mt -62.44 -35.43 69.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.848 0.832 . . . . 73.400000000000006 109.686 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -69.17 -29.96 68.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.762 -0.654 . . . . 61.140000000000001 110.512 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.62 -39.15 70.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.431 -0.804 . . . . 74.040000000000006 110.657 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.4 tt -74.99 -33.41 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 116.237 -0.438 . . . . 55.140000000000001 110.455 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.26 -36.2 79.05 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.236 0.541 . . . . 74.400000000000006 110.059 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -61.11 -50.96 71.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.026 -0.988 . . . . 73.430000000000007 108.886 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -55.73 -38.85 70.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 113.847 -1.524 . . . . 62.43 111.739 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 87.1 mt -64.42 -35.27 80.36 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.114 -0.494 . . . . 62.140000000000001 111.901 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 68.52 -132.65 27.42 Favored Glycine 0 CA--C 1.48 -2.102 0 C-N-CA 119.776 -1.202 . . . . 51.409999999999997 112.685 178.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.97 -32.3 45.41 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.131 -1.035 . . . . 73.129999999999995 112.242 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -69.34 -14.38 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.083 0.468 . . . . 72.140000000000001 111.88 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . 0.492 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -69.96 -15.45 63.04 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.016 0.436 . . . . 65.420000000000002 110.596 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 21.0 m -77.11 -24.05 51.75 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 122.237 -0.289 . . . . 74.219999999999999 111.757 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . 0.433 ' OD2' ' HB3' ' A' ' 496' ' ' LYS . 30.6 t70 -106.2 -3.13 21.71 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.946 -0.471 . . . . 72.450000000000003 111.728 -178.054 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 469' ' ' ALA . 10.6 tt -59.84 146.11 10.63 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 CA-C-O 120.928 0.394 . . . . 54.329999999999998 110.771 -176.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . 0.454 ' NH2' ' HA ' ' A' ' 496' ' ' LYS . 15.2 tpp180 -74.1 139.38 44.56 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 105.773 -1.936 . . . . 73.25 105.773 175.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 21.4 m -72.03 116.42 12.42 Favored 'General case' 0 C--N 1.278 -2.536 0 N-CA-C 109.655 -0.498 . . . . 72.329999999999998 109.655 -173.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 9.6 m170 67.19 21.93 9.88 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.789 0.835 . . . . 72.030000000000001 111.554 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.79 -6.06 88.81 Favored Glycine 0 N--CA 1.439 -1.12 0 CA-C-N 115.252 -0.886 . . . . 61.299999999999997 111.316 177.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.4 p -84.44 119.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 CA-C-O 121.169 0.509 . . . . 60.210000000000001 109.921 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -134.69 120.52 19.6 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.05 -0.722 . . . . 72.439999999999998 109.05 -178.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 65.8 mtt -97.59 147.75 23.98 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 108.243 -1.021 . . . . 73.420000000000002 108.243 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.1 t -94.95 109.46 22.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 CA-C-O 121.602 0.715 . . . . 53.439999999999998 110.671 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 487' ' ' PRO . 2.9 mp -98.87 146.49 25.91 Favored 'General case' 0 N--CA 1.427 -1.598 0 N-CA-C 107.545 -1.279 . . . . 64.340000000000003 107.545 172.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -90.08 -179.82 5.76 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.826 -1.546 . . . . 71.25 106.826 -175.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.9 -16.35 64.26 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 114.371 1.248 . . . . 64.340000000000003 114.371 -173.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -81.61 -10.08 59.52 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.515 0.674 . . . . 70.430000000000007 109.484 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.72 32.1 25.2 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.513 -0.767 . . . . 75.230000000000004 111.589 -177.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 30.3 mmt180 -119.31 131.87 24.2 Favored Pre-proline 0 C--N 1.309 -1.193 0 N-CA-C 107.959 -1.126 . . . . 74.120000000000005 107.959 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 481' ' ' LEU . 51.4 Cg_exo -57.47 129.76 35.57 Favored 'Trans proline' 0 C--O 1.243 0.76 0 C-N-CA 122.226 1.951 . . . . 74.109999999999999 111.205 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 8.0 p -73.95 -28.44 61.5 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.83 0.824 . . . . 72.530000000000001 108.982 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 120.72 -15.08 9.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 114.89 -1.05 . . . . 65.219999999999999 111.455 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -100.39 161.37 13.64 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 120.932 0.396 . . . . 71.140000000000001 110.155 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -159.38 177.56 10.85 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.923 -0.581 . . . . 73.519999999999996 109.818 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -135.12 143.03 46.35 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 124.566 1.147 . . . . 71.129999999999995 108.657 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 53.7 mt -139.73 135.77 39.17 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 N-CA-C 107.143 -1.429 . . . . 53.539999999999999 107.143 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -111.59 138.48 48.07 Favored 'General case' 0 C--N 1.272 -2.785 0 C-N-CA 118.934 -1.106 . . . . 75.019999999999996 108.415 175.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.45 ' SD ' HD11 ' A' ' 447' ' ' ILE . 79.0 mtp -104.71 -176.75 3.17 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.724 -0.843 . . . . 61.140000000000001 108.724 175.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.454 ' HA ' ' NH2' ' A' ' 473' ' ' ARG . 3.2 ttmp? -88.21 -39.31 14.57 Favored 'General case' 0 C--N 1.281 -2.384 0 CA-C-O 121.338 0.589 . . . . 61.039999999999999 109.642 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 15.6 m -114.26 141.67 47.27 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 115.1 -0.954 . . . . 74.219999999999999 111.502 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.11 67.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.207 -0.906 . . . . 62.240000000000002 109.02 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -67.27 -45.69 75.87 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-N 114.813 -1.085 . . . . 61.200000000000003 110.544 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -70.76 -36.19 72.98 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.507 -0.77 . . . . 70.349999999999994 110.346 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -61.67 -41.46 97.57 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 123.551 0.532 . . . . 70.140000000000001 110.331 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -62.24 -43.69 98.26 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.918 -0.583 . . . . 71.329999999999998 110.935 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 89.7 mtp -65.05 -41.24 95.35 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.172 -0.467 . . . . 74.049999999999997 110.516 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.81 -42.53 94.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.145 -0.48 . . . . 61.520000000000003 110.461 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.05 -38.49 85.92 Favored 'General case' 0 C--O 1.195 -1.807 0 CA-C-N 116.134 -0.484 . . . . 63.219999999999999 111.056 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.95 -42.84 72.7 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.476 0.655 . . . . 72.450000000000003 110.072 178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -68.29 -34.31 75.93 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.668 -0.696 . . . . 61.409999999999997 110.55 -177.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 34.7 m -115.1 19.01 16.0 Favored 'General case' 0 N--CA 1.425 -1.714 0 N-CA-C 112.993 0.738 . . . . 71.510000000000005 112.993 -174.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 34.7 t-80 -69.23 93.51 0.62 Allowed 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.511 -0.743 . . . . 71.239999999999995 110.299 176.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.407 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 45.6 tttp 71.0 30.04 2.83 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.399 1.479 . . . . 65.150000000000006 109.717 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.08 141.91 40.03 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.25 -1.341 . . . . 61.140000000000001 108.919 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -77.63 145.79 36.53 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-O 121.256 0.551 . . . . 65.420000000000002 110.797 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -129.77 102.17 6.21 Favored 'General case' 0 C--N 1.288 -2.091 0 N-CA-C 106.35 -1.722 . . . . 54.130000000000003 106.35 173.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 66.1 -81.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 124.712 1.205 . . . . 63.450000000000003 111.958 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -134.76 -2.37 2.66 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 123.399 0.68 . . . . 64.209999999999994 112.07 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -115.02 161.39 18.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 107.784 -1.191 . . . . 73.010000000000005 107.784 -176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -113.36 121.43 44.33 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.705 -0.479 . . . . 75.430000000000007 109.705 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 59.2 t -99.11 112.76 32.11 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.183 0 O-C-N 124.161 0.913 . . . . 71.450000000000003 108.638 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . 0.426 ' OE2' ' HD2' ' A' ' 450' ' ' ARG . 49.7 mt-10 -96.29 112.71 24.36 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.146 -1.057 . . . . 71.420000000000002 108.146 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . 0.595 HG22 HD22 ' A' ' 449' ' ' LEU . 93.6 t -104.38 115.6 46.59 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.24 0 CA-C-N 115.382 -0.827 . . . . 71.209999999999994 109.602 -177.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.99 147.94 32.56 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 108.491 -0.929 . . . . 73.310000000000002 108.491 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -105.34 153.36 21.74 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.259 -1.015 . . . . 72.129999999999995 108.259 -178.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.8 p -162.79 168.77 20.94 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.259 0.552 . . . . 72.349999999999994 111.906 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.595 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 69.3 m -91.9 160.14 15.43 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-N 115.359 -0.837 . . . . 62.32 112.444 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -51.73 -36.31 46.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.675 -1.148 . . . . 72.150000000000006 111.667 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -64.59 -51.14 64.27 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 108.967 -0.753 . . . . 73.230000000000004 108.967 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -39.08 90.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.024 -0.535 . . . . 71.219999999999999 111.101 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . 0.512 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.2 ttt -66.81 -45.15 79.26 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.906 -0.588 . . . . 73.299999999999997 110.499 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -71.73 -31.56 66.83 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.806 -0.442 . . . . 75.510000000000005 109.806 -176.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -61.31 -47.37 86.24 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 123.899 0.88 . . . . 75.109999999999999 110.588 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 48.4 t -70.39 -35.09 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.332 -0.547 . . . . 72.200000000000003 109.588 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.2 mt . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.195 -0.457 . . . . 63.520000000000003 110.822 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.3 t . . . . . 0 C--O 1.245 0.828 0 N-CA-C 109.537 -0.542 . . . . 71.400000000000006 109.537 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.54 ' HG3' ' OG ' ' A' ' 524' ' ' SER . 7.6 mpt_? -102.28 67.02 1.02 Allowed 'General case' 0 C--O 1.209 -1.059 0 N-CA-C 110.026 -0.361 . . . . 73.140000000000001 110.026 -176.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -124.82 14.87 8.63 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 112.592 0.59 . . . . 63.109999999999999 112.592 -176.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 20.4 m -108.84 151.64 25.98 Favored 'General case' 0 N--CA 1.413 -2.284 0 N-CA-C 108.462 -0.94 . . . . 21.420000000000002 108.462 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.81 132.55 69.96 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.722 0 N-CA-C 108.655 -0.868 . . . . 71.319999999999993 108.655 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -106.02 121.41 44.07 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 108.356 -0.979 . . . . 75.120000000000005 108.356 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . 0.437 HD22 HG22 ' A' ' 520' ' ' VAL . 18.3 mt -104.45 150.44 24.56 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.684 -1.228 . . . . 72.200000000000003 107.684 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . 0.412 HH21 ' CD ' ' A' ' 519' ' ' GLU . 60.6 ttp180 -146.52 131.63 18.32 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.853 -0.425 . . . . 73.030000000000001 109.853 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.32 41.06 2.12 Favored Glycine 0 C--N 1.289 -2.036 0 CA-C-N 115.737 -0.665 . . . . 65.540000000000006 111.653 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.06 130.85 89.38 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.16 . . . . 64.049999999999997 111.388 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . 0.506 ' HB2' ' HB2' ' A' ' 456' ' ' ALA . 37.6 Cg_exo -58.91 156.83 31.39 Favored 'Trans proline' 0 N--CA 1.447 -1.216 0 C-N-CA 122.808 2.339 . . . . 74.319999999999993 112.67 176.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -78.14 93.11 4.5 Favored 'General case' 0 N--CA 1.408 -2.537 0 CA-C-N 114.103 -1.408 . . . . 74.310000000000002 110.006 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.83 25.76 0.03 OUTLIER 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 112.732 -2.031 . . . . 72.409999999999997 113.325 172.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 453' ' ' PRO . . . -69.39 135.87 50.9 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.375 -1.342 . . . . 72.150000000000006 107.375 172.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.2 p -89.26 174.7 7.69 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-O 120.884 0.373 . . . . 73.430000000000007 111.795 -175.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.454 ' HA ' HG22 ' A' ' 461' ' ' ILE . 72.8 mt -61.48 -38.05 79.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 N-CA-C 108.886 -0.783 . . . . 71.519999999999996 108.886 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -64.73 -37.3 87.14 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.403 -0.817 . . . . 72.319999999999993 110.714 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -68.75 -43.4 75.92 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.061 0.458 . . . . 60.299999999999997 110.437 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 465' ' ' LEU . 12.6 tt -71.85 -33.0 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 CA-C-N 115.839 -0.619 . . . . 53.340000000000003 110.621 -175.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.424 ' HG ' ' HB1' ' A' ' 469' ' ' ALA . 8.1 mp -70.8 -30.64 67.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.9 0.381 . . . . 75.519999999999996 110.9 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.93 -48.23 66.53 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.207 -1.035 . . . . 61.32 108.207 175.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -54.63 -42.74 71.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.17 -1.377 . . . . 75.329999999999998 111.102 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 90.0 mt -64.95 -31.66 73.01 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.811 -0.631 . . . . 72.219999999999999 111.811 178.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 85.83 -149.41 23.28 Favored Glycine 0 N--CA 1.422 -2.268 0 C-N-CA 120.51 -0.852 . . . . 72.510000000000005 111.431 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -66.31 -22.52 66.28 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.031 -0.585 . . . . 63.409999999999997 111.005 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -62.81 -17.44 61.24 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.808 -0.633 . . . . 74.150000000000006 111.101 178.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . 0.424 ' HB1' ' HG ' ' A' ' 462' ' ' LEU . . . -67.44 -15.32 63.61 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 116.059 -0.519 . . . . 72.540000000000006 110.979 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.3 m -85.83 -3.27 58.87 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.759 0.79 . . . . 65.310000000000002 109.508 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . 0.439 ' CG ' ' HE ' ' A' ' 500' ' ' ARG . 3.8 m-20 -112.93 13.95 19.65 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.996 -0.547 . . . . 74.319999999999993 110.771 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 15.8 tt -72.07 150.63 8.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.282 -0.872 . . . . 72.400000000000006 109.017 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -80.34 151.84 29.26 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 109.542 -0.54 . . . . 72.120000000000005 109.542 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 1.4 m -59.24 114.41 2.63 Favored 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.881 1.273 . . . . 74.400000000000006 109.704 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 59.93 33.21 21.46 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.746 0.818 . . . . 72.549999999999997 110.726 -178.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -98.35 37.04 3.64 Favored Glycine 0 N--CA 1.432 -1.584 0 CA-C-N 116.059 -0.519 . . . . 73.129999999999995 114.32 -174.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 59.0 t -118.41 111.47 34.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.304 0 N-CA-C 109.016 -0.735 . . . . 71.109999999999999 109.016 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 29.9 m-70 -127.65 100.47 5.99 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.243 0.544 . . . . 62.210000000000001 111.396 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . 0.408 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 66.7 mtt -82.61 142.75 31.51 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.907 -0.775 . . . . 71.340000000000003 108.907 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 46.9 t -88.01 107.49 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.685 0 N-CA-C 107.214 -1.402 . . . . 62.219999999999999 107.214 176.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.8 pp -93.11 158.51 15.74 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.626 -0.715 . . . . 74.439999999999998 112.458 -178.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -91.93 173.2 7.97 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 106.342 -1.725 . . . . 75.129999999999995 106.342 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -56.05 -27.46 53.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.184 0.447 . . . . 71.439999999999998 111.219 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . 0.435 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 35.3 tt0 -69.41 -20.23 63.8 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 121.161 0.505 . . . . 72.450000000000003 111.345 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 90.87 25.58 24.49 Favored Glycine 0 N--CA 1.435 -1.403 0 CA-C-O 121.463 0.48 . . . . 13.550000000000001 112.898 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.435 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 91.3 mtt180 -126.79 144.78 51.2 Favored Pre-proline 0 C--N 1.303 -1.445 0 N-CA-C 108.037 -1.097 . . . . 70.540000000000006 108.037 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -53.17 136.18 61.26 Favored 'Trans proline' 0 C--O 1.245 0.868 0 C-N-CA 123.113 2.542 . . . . 75.319999999999993 113.055 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.2 m -80.01 1.58 27.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.461 -0.79 . . . . 62.109999999999999 111.142 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.85 -30.0 6.57 Favored Glycine 0 CA--C 1.488 -1.656 0 N-CA-C 111.235 -0.746 . . . . 72.030000000000001 111.235 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -107.22 152.84 23.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.06 0.457 . . . . 70.409999999999997 110.86 179.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.408 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -158.11 169.38 24.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.498 -0.774 . . . . 61.229999999999997 109.184 -176.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -127.71 129.88 47.87 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-N 116.182 -0.463 . . . . 60.439999999999998 109.775 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 43.3 mt -122.27 133.01 69.85 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.378 0 N-CA-C 105.977 -1.86 . . . . 74.340000000000003 105.977 172.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -108.54 136.57 47.92 Favored 'General case' 0 C--N 1.271 -2.812 0 N-CA-C 109.571 -0.529 . . . . 74.519999999999996 109.571 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.72 172.59 6.72 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 123.214 0.606 . . . . 62.130000000000003 111.442 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -65.07 -43.93 90.58 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.179 0.991 . . . . 75.129999999999995 110.181 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 51.0 p -141.03 155.98 46.09 Favored 'General case' 0 N--CA 1.42 -1.943 0 CA-C-N 116.302 -0.408 . . . . 73.5 111.785 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.54 -40.88 93.14 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.02 -0.991 . . . . 72.340000000000003 111.392 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.56 -37.84 87.85 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.093 -0.958 . . . . 71.430000000000007 111.932 -174.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . 0.439 ' HE ' ' CG ' ' A' ' 471' ' ' ASP . 26.0 mmm180 -75.94 -40.77 53.39 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.405 -0.816 . . . . 71.400000000000006 109.741 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.34 -41.84 98.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.362 -0.835 . . . . 70.450000000000003 111.008 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . 0.404 ' HA ' ' HG3' ' A' ' 522' ' ' GLN . 66.1 t80 -64.6 -40.06 94.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.855 -0.611 . . . . 72.5 110.978 -178.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 55.6 ttm -70.32 -37.63 74.76 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.303 -0.559 . . . . 65.109999999999999 110.304 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.004 -0.544 . . . . 34.32 110.644 178.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.14 -32.18 70.04 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.076 -0.511 . . . . 74.230000000000004 111.836 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -72.89 -34.8 66.91 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.335 0.588 . . . . 55.329999999999998 109.772 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -68.69 -41.7 78.81 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.438 -0.801 . . . . 73.439999999999998 110.778 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 62.2 m -105.5 20.68 18.48 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 112.558 0.577 . . . . 71.129999999999995 112.558 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.89 92.32 0.23 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.384 0.611 . . . . 63.229999999999997 110.572 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 82.7 tttt 64.31 62.74 0.81 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.501 1.52 . . . . 74.409999999999997 110.041 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -105.82 139.38 40.48 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 113.429 -1.714 . . . . 64.450000000000003 107.763 179.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 517' ' ' TYR . 3.2 p-10 -75.78 140.72 42.5 Favored 'General case' 0 C--N 1.293 -1.879 0 CA-C-O 121.216 0.532 . . . . 72.239999999999995 111.268 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.7 ttt -126.19 90.68 3.23 Favored 'General case' 0 N--CA 1.415 -2.19 0 N-CA-C 105.576 -2.009 . . . . 75.439999999999998 105.576 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp 68.55 -84.86 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.928 -1.487 . . . . 72.439999999999998 110.573 -177.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -107.35 -35.87 6.67 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 115.966 -0.561 . . . . 74.540000000000006 112.082 -177.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.4 ttm105 -108.63 153.1 23.89 Favored 'General case' 0 C--N 1.273 -2.76 0 CA-C-N 114.992 -1.003 . . . . 65.0 109.833 -165.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 512' ' ' ASN . 7.6 p90 -101.2 121.29 41.58 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 121.219 0.533 . . . . 70.530000000000001 112.083 -177.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.55 109.97 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.277 0 CA-C-N 114.887 -1.052 . . . . 53.450000000000003 108.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . 0.412 ' CD ' HH21 ' A' ' 450' ' ' ARG . 37.2 mt-10 -89.41 110.86 21.63 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 107.808 -1.182 . . . . 64.200000000000003 107.808 178.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . 0.437 HG22 HD22 ' A' ' 449' ' ' LEU . 85.5 t -104.4 123.43 58.27 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.143 0 CA-C-N 115.874 -0.603 . . . . 73.030000000000001 109.501 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -122.07 135.32 54.8 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.006 -0.739 . . . . 65.140000000000001 109.006 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . 0.404 ' HG3' ' HA ' ' A' ' 502' ' ' PHE . 0.0 OUTLIER -90.85 125.63 35.79 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 106.828 -1.545 . . . . 52.200000000000003 106.828 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 62.4 m -134.49 170.31 15.95 Favored 'General case' 0 C--N 1.284 -2.24 0 CA-C-N 115.348 -0.842 . . . . 50.420000000000002 111.014 -171.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.54 ' OG ' ' HG3' ' A' ' 444' ' ' ARG . 44.4 m -92.69 164.1 13.52 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 116.278 -0.419 . . . . 50.240000000000002 110.721 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.91 -23.05 63.19 Favored 'General case' 0 C--O 1.209 -1.063 0 CA-C-N 115.552 -0.749 . . . . 73.209999999999994 111.056 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.55 -50.31 70.0 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.146 -0.479 . . . . 72.400000000000006 110.379 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.6 -40.59 95.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.185 0.517 . . . . 70.120000000000005 110.607 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . 0.506 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 27.8 ttt -67.01 -44.43 80.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.631 -0.713 . . . . 70.349999999999994 110.417 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.13 -35.95 80.82 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-N 116.12 -0.491 . . . . 71.409999999999997 110.164 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -62.73 -46.2 89.17 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.983 -0.553 . . . . 72.310000000000002 110.664 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 58.4 t -74.35 -31.79 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 120.327 -0.549 . . . . 73.099999999999994 110.911 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 528' ' ' MET . 73.3 mt . . . . . 0 C--N 1.322 -0.61 0 CA-C-O 120.909 0.385 . . . . 74.439999999999998 110.869 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.437 -1.076 0 N-CA-C 109.522 -0.548 . . . . 72.109999999999999 109.522 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 444' ' ' ARG . . . . . 0.657 ' HB2' ' NE2' ' A' ' 522' ' ' GLN . 22.1 ptt180 -87.25 51.91 2.36 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 122.545 1.164 . . . . 75.140000000000001 109.525 176.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -101.93 9.25 40.72 Favored 'General case' 0 C--N 1.3 -1.543 0 CA-C-N 114.144 -1.389 . . . . 75.230000000000004 111.288 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 44.3 m -107.54 149.36 28.09 Favored 'General case' 0 N--CA 1.412 -2.351 0 C-N-CA 119.559 -0.857 . . . . 65.030000000000001 109.948 -176.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 447' ' ' ILE . . . . . 0.664 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.5 mt -122.08 141.47 42.36 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.936 0 N-CA-C 106.892 -1.522 . . . . 71.049999999999997 106.892 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -116.63 124.94 51.01 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 108.101 -1.074 . . . . 74.140000000000001 108.101 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.6 mt -108.88 125.46 52.02 Favored 'General case' 0 C--N 1.279 -2.483 0 N-CA-C 106.038 -1.838 . . . . 70.420000000000002 106.038 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -136.52 137.26 40.11 Favored 'General case' 0 C--N 1.274 -2.709 0 CA-C-O 121.32 0.581 . . . . 54.149999999999999 110.372 -176.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 95.08 23.0 21.36 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 110.279 -1.128 . . . . 61.539999999999999 110.279 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.9 mt -60.11 145.46 85.15 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 123.899 0.88 . . . . 72.409999999999997 111.932 -178.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -59.98 158.96 27.3 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 C-N-CA 122.836 2.357 . . . . 61.450000000000003 113.707 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -77.17 95.1 4.2 Favored 'General case' 0 N--CA 1.396 -3.161 0 CA-C-N 113.004 -1.907 . . . . 75.340000000000003 109.683 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 87.74 26.84 0.04 OUTLIER 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 112.362 -2.199 . . . . 71.329999999999998 112.926 171.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -67.55 136.2 54.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.579 -0.737 . . . . 60.020000000000003 109.228 173.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 5.8 p -85.68 151.9 23.51 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 115.663 -0.699 . . . . 74.450000000000003 109.574 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 458' ' ' ILE . . . . . 0.621 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.253 2.7 pp -62.3 -29.66 47.17 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.763 0 C-N-CA 120.003 -0.679 . . . . 73.340000000000003 112.606 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.86 -29.42 67.73 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.884 0.374 . . . . 70.420000000000002 111.224 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -75.51 -40.09 57.57 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.929 -0.767 . . . . 60.43 108.929 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' ILE . . . . . 0.443 HG22 ' HA ' ' A' ' 458' ' ' ILE . 12.4 tt -75.07 -28.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 C-N-CA 120.137 -0.625 . . . . 52.229999999999997 111.07 -179.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 87.0 mt -63.62 -34.84 78.71 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.676 -0.49 . . . . 75.200000000000003 109.676 175.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.19 -48.54 70.33 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.341 -0.985 . . . . 72.329999999999998 108.341 176.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.74 -41.18 70.09 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 113.992 -1.458 . . . . 72.340000000000003 111.2 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 97.0 mt -69.65 -37.39 76.73 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.013 -0.539 . . . . 75.519999999999996 110.325 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 87.29 -146.65 20.36 Favored Glycine 0 N--CA 1.418 -2.509 0 C-N-CA 120.758 -0.734 . . . . 63.240000000000002 112.97 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -49.75 -30.54 9.66 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 126.343 1.857 . . . . 73.040000000000006 113.275 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -61.62 -19.58 62.41 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.38 0.672 . . . . 72.510000000000005 112.368 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -61.9 -15.29 41.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.213 0.82 . . . . 72.420000000000002 113.213 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 12.8 t -86.58 -15.02 41.16 Favored 'General case' 0 CA--C 1.551 1.012 0 O-C-N 121.694 -0.629 . . . . 53.0 111.548 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . 0.403 ' HB3' ' CE ' ' A' ' 495' ' ' MET . 36.9 t70 -102.42 13.44 34.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.167 0.984 . . . . 51.299999999999997 110.469 -174.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 11.2 tt -73.53 152.62 7.31 Favored 'Isoleucine or valine' 0 C--O 1.248 1.013 0 CA-C-N 115.195 -0.911 . . . . 72.329999999999998 109.202 177.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -83.87 144.59 29.13 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 119.836 -0.745 . . . . 64.219999999999999 109.126 173.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 20.4 m -59.9 119.31 7.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.783 -0.821 . . . . 72.239999999999995 108.783 176.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 36.2 t-80 68.11 21.55 8.65 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.305 1.05 . . . . 64.239999999999995 109.257 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.75 -15.99 80.5 Favored Glycine 0 N--CA 1.438 -1.176 0 CA-C-N 115.512 -0.767 . . . . 63.0 112.296 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -83.67 123.81 39.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.445 0.641 . . . . 62.43 110.404 178.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -133.24 117.12 17.02 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.674 -0.861 . . . . 74.109999999999999 108.674 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.0 mtt -91.87 145.5 24.5 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-O 120.676 0.274 . . . . 64.230000000000004 110.341 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.9 t -84.61 96.33 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.545 0 N-CA-C 105.74 -1.948 . . . . 74.5 105.74 172.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.3 pp -96.03 161.42 13.99 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 114.209 -1.36 . . . . 71.319999999999993 113.356 -176.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.02 162.98 16.52 Favored 'General case' 0 C--N 1.282 -2.336 0 N-CA-C 104.098 -2.556 . . . . 71.239999999999995 104.098 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 64.3 m80 -70.31 -5.16 25.92 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 119.788 1.176 . . . . 72.25 112.411 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -83.39 -7.02 59.63 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.073 -0.967 . . . . 75.310000000000002 109.143 172.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 81.29 29.15 41.68 Favored Glycine 0 CA--C 1.495 -1.218 0 CA-C-N 115.746 -0.661 . . . . 55.439999999999998 112.859 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -117.43 127.41 26.69 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 108.669 -0.863 . . . . 61.32 108.669 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.78 126.63 19.39 Favored 'Trans proline' 0 C--O 1.243 0.772 0 C-N-CA 122.347 2.032 . . . . 52.229999999999997 111.197 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.6 m -74.95 -2.14 25.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.892 -0.594 . . . . 71.400000000000006 112.068 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 107.56 10.93 26.19 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.88 -0.676 . . . . 54.43 111.737 179.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -132.25 138.31 47.86 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.168 -1.419 . . . . 63.149999999999999 107.168 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.17 161.37 30.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.868 0.366 . . . . 45.109999999999999 110.73 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -122.9 142.81 50.39 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 123.3 0.64 . . . . 72.239999999999995 109.3 177.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 60.8 mt -128.62 126.5 65.37 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.228 0 N-CA-C 107.491 -1.299 . . . . 53.43 107.491 174.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -100.19 126.36 46.46 Favored 'General case' 0 C--N 1.275 -2.648 0 N-CA-C 109.539 -0.541 . . . . 51.310000000000002 109.539 177.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' MET . . . . . 0.664 ' SD ' HD11 ' A' ' 447' ' ' ILE . 82.9 mtp -100.47 170.38 8.43 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 108.364 -0.976 . . . . 74.439999999999998 108.364 177.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -80.82 -35.59 32.72 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.4 -0.592 . . . . 72.430000000000007 109.4 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.5 m -122.06 141.36 51.46 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-O 121.469 0.652 . . . . 73.129999999999995 111.205 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -76.18 -22.71 55.0 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.9 . . . . 71.439999999999998 111.84 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -70.97 -40.93 71.64 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.782 -0.644 . . . . 73.25 110.753 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -38.41 67.2 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.279 -0.873 . . . . 75.0 111.753 173.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . 0.418 ' HA ' ' SD ' ' A' ' 495' ' ' MET . . . -57.81 -44.73 86.54 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.196 0.522 . . . . 53.520000000000003 110.779 178.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -63.13 -39.2 94.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.631 -0.713 . . . . 70.209999999999994 110.426 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.85 -34.99 72.21 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.64 0.237 . . . . 75.040000000000006 111.64 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.15 -43.24 82.83 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.56 -0.533 . . . . 64.140000000000001 109.56 177.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -66.45 -29.67 69.85 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.897 -0.592 . . . . 74.230000000000004 110.901 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -71.52 -44.69 64.17 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.458 -0.571 . . . . 63.299999999999997 109.458 177.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.2 -44.51 96.42 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.611 -0.722 . . . . 73.439999999999998 110.347 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 58.9 m -98.71 10.44 41.14 Favored 'General case' 0 N--CA 1.421 -1.907 0 N-CA-C 113.513 0.931 . . . . 34.119999999999997 113.513 -173.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 509' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 32.7 t60 -77.06 104.35 7.5 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 119.439 -0.904 . . . . 73.230000000000004 109.453 174.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 73.01 19.43 3.7 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.72 1.208 . . . . 74.430000000000007 110.617 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.02 146.67 26.55 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.502 -1.296 . . . . 70.010000000000005 107.502 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -98.04 149.52 22.38 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 118.666 -1.214 . . . . 75.200000000000003 111.673 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.0 ttt -120.17 113.0 19.79 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 104.946 -2.242 . . . . 52.329999999999998 104.946 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.3 mttm 69.99 -87.19 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.118 -1.067 . . . . 72.329999999999998 108.118 -172.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.25 1.53 1.24 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.314 0.646 . . . . 74.409999999999997 111.417 175.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -103.99 142.58 34.19 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 107.566 -1.272 . . . . 71.219999999999999 107.566 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -95.24 125.35 39.82 Favored 'General case' 0 C--N 1.265 -3.077 0 CA-C-O 121.489 0.661 . . . . 73.310000000000002 110.7 -176.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 61.4 t -102.23 127.39 55.84 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.666 0 N-CA-C 106.881 -1.525 . . . . 72.200000000000003 106.881 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -103.77 109.21 20.84 Favored 'General case' 0 N--CA 1.411 -2.404 0 N-CA-C 108.221 -1.029 . . . . 75.439999999999998 108.221 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.0 t -106.73 134.28 48.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 CA-C-N 115.15 -0.932 . . . . 61.43 110.623 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -125.33 159.9 30.63 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.437 -0.949 . . . . 73.530000000000001 108.437 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 522' ' ' GLN . . . . . 0.657 ' NE2' ' HB2' ' A' ' 444' ' ' ARG . 1.0 OUTLIER -101.68 139.49 37.25 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.392 -1.336 . . . . 40.100000000000001 107.392 177.482 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 523' ' ' CYS . . . . . 0.403 ' N ' HE21 ' A' ' 522' ' ' GLN . 65.1 m -141.01 169.47 17.54 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.86 0.362 . . . . 62.409999999999997 110.724 -175.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.3 p -99.2 159.96 14.61 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.999 -0.546 . . . . 62.43 109.931 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -56.99 -30.88 64.52 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 123.614 0.571 . . . . 63.409999999999997 109.646 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.36 -52.56 57.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.377 1.071 . . . . 55.039999999999999 110.068 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -59.68 -42.81 93.75 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.675 0.75 . . . . 73.340000000000003 109.076 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 22.1 ttt -62.01 -45.04 95.33 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 114.586 -1.188 . . . . 74.519999999999996 110.199 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.99 -39.3 87.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.938 -0.573 . . . . 65.420000000000002 109.761 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -68.31 -39.12 82.12 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.079 -0.509 . . . . 71.340000000000003 110.764 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 91.5 t -73.3 -38.11 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 C-N-CA 120.233 -0.587 . . . . 63.130000000000003 110.469 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 121.204 0.526 . . . . 70.230000000000004 111.772 -178.726 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 CA--C 1.513 -0.459 0 N-CA-C 108.034 -1.099 . . . . 61.340000000000003 108.034 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . 0.407 ' HA ' ' HD3' ' A' ' 440' ' ' PRO . 45.9 Cg_endo -71.13 127.26 13.29 Favored 'Trans proline' 0 C--O 1.248 1.021 0 C-N-CA 121.858 1.705 . . . . 65.099999999999994 111.594 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 439' ' ' PRO . 33.7 Cg_exo -60.71 107.02 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.454 2.103 . . . . 53.229999999999997 110.419 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 25.8 m -97.61 131.57 44.07 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-N 115.742 -0.663 . . . . 74.239999999999995 109.414 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' A' ' 524' ' ' SER . 51.9 t30 -80.34 95.94 6.52 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.493 -0.558 . . . . 75.450000000000003 109.493 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 30.3 t -108.87 153.53 10.56 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 107.401 -1.333 . . . . 55.329999999999998 107.401 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.563 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 59.0 mtp85 -90.06 62.25 5.49 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 121.851 0.834 . . . . 74.510000000000005 109.813 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.2 p30 -111.43 11.73 21.46 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-N 115.005 -0.998 . . . . 71.409999999999997 110.168 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 494' ' ' GLN . 28.3 m -109.07 151.28 26.6 Favored 'General case' 0 N--CA 1.408 -2.539 0 N-CA-C 107.797 -1.186 . . . . 64.319999999999993 107.797 -177.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . 0.441 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.2 mt -132.13 143.9 38.7 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.39 0 N-CA-C 108.354 -0.98 . . . . 64.010000000000005 108.354 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -112.29 119.1 37.16 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 108.056 -1.09 . . . . 64.129999999999995 108.056 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 10.6 mt -94.42 141.5 28.51 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.505 -2.035 . . . . 71.129999999999995 105.505 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . 0.47 ' HE ' ' CG ' ' A' ' 490' ' ' ASP . 0.0 OUTLIER -142.65 135.83 28.48 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 119.53 -0.868 . . . . 75.019999999999996 109.861 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 450' ' ' ARG . . . 99.51 22.26 13.03 Favored Glycine 0 C--N 1.28 -2.576 0 CA-C-N 114.474 -1.239 . . . . 74.120000000000005 112.188 177.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.75 144.59 96.35 Favored Pre-proline 0 C--O 1.242 0.66 0 C-N-CA 122.883 0.473 . . . . 70.409999999999997 111.974 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -57.21 160.65 12.73 Favored 'Trans proline' 0 C--O 1.252 1.218 0 C-N-CA 123.395 2.73 . . . . 64.010000000000005 113.762 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -77.19 98.61 5.15 Favored 'General case' 0 N--CA 1.401 -2.903 0 CA-C-N 113.952 -1.476 . . . . 70.340000000000003 108.686 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.96 30.43 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.485 0 CA-C-N 111.966 -2.379 . . . . 65.510000000000005 111.971 172.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -54.2 121.87 9.09 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 108.425 -0.954 . . . . 62.340000000000003 108.425 171.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 7.2 p -81.02 169.35 17.61 Favored 'General case' 0 N--CA 1.414 -2.27 0 CA-C-N 115.963 -0.562 . . . . 70.019999999999996 111.952 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.651 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 16.2 tt -67.1 -31.69 54.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 CA-C-N 116.185 -0.461 . . . . 72.120000000000005 111.957 -174.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -80.25 -28.19 38.52 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.74 -0.784 . . . . 73.420000000000002 110.264 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.62 -40.1 80.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.14 -0.936 . . . . 70.109999999999999 108.968 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.5 tt -71.01 -32.88 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 115.41 -0.814 . . . . 75.219999999999999 110.065 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 93.1 mt -68.25 -40.08 82.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.327 -0.249 . . . . 75.549999999999997 110.327 178.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.97 -52.43 64.2 Favored 'General case' 0 CA--C 1.502 -0.894 0 CA-C-O 121.502 0.667 . . . . 60.219999999999999 109.28 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -53.97 -39.4 65.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.905 -1.498 . . . . 70.420000000000002 111.878 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 94.7 mt -72.64 -36.49 68.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.915 -0.584 . . . . 61.439999999999998 111.92 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.82 -140.41 25.86 Favored Glycine 0 N--CA 1.43 -1.72 0 C-N-CA 119.85 -1.167 . . . . 52.340000000000003 111.855 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.46 -17.85 63.15 Favored 'General case' 0 C--N 1.287 -2.133 0 CA-C-N 114.603 -0.798 . . . . 75.040000000000006 113.017 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -70.6 -22.02 62.59 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.352 0.596 . . . . 75.450000000000003 110.899 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.4 -14.65 62.65 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.453 0.644 . . . . 73.430000000000007 110.521 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 15.9 m -81.68 -18.21 45.31 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 111.222 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -112.97 16.13 19.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.998 0.904 . . . . 74.420000000000002 110.672 -177.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -66.81 145.58 13.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.879 0 CA-C-N 115.761 -0.654 . . . . 73.099999999999994 109.438 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -78.5 155.29 29.88 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.3 -1.37 . . . . 64.140000000000001 107.3 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 12.3 p -54.75 114.22 1.62 Allowed 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 123.426 0.69 . . . . 51.140000000000001 111.382 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 63.11 26.19 15.24 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.69 0.796 . . . . 51.240000000000002 111.968 -176.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.18 70.88 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 116.291 -0.413 . . . . 71.109999999999999 113.596 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.2 p -85.7 114.26 25.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.894 0.854 . . . . 73.120000000000005 112.245 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -124.78 113.76 18.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.079 -0.964 . . . . 73.150000000000006 109.508 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 66.1 mtt -88.94 136.97 32.73 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.924 -0.769 . . . . 74.140000000000001 108.924 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.61 121.12 37.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 N-CA-C 108.93 -0.767 . . . . 73.329999999999998 108.93 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 85.6 mt -92.95 158.7 15.68 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.756 -0.831 . . . . 75.430000000000007 108.756 179.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -106.6 -174.64 2.58 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.78 -1.563 . . . . 74.120000000000005 106.78 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -53.8 -39.96 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.771 0.828 . . . . 70.129999999999995 111.858 -176.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -68.68 -12.7 61.71 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.563 0.745 . . . . 63.439999999999998 111.993 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 84.48 24.21 47.76 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.454 -0.658 . . . . 75.219999999999999 111.454 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -127.86 152.86 77.85 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 106.937 -1.505 . . . . 72.430000000000007 106.937 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -50.55 135.12 40.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.308 2.672 . . . . 62.130000000000003 114.914 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 43.2 t -76.16 -18.75 58.97 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.662 -1.154 . . . . 73.129999999999995 109.11 176.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 102.09 -2.07 51.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 109.091 -1.603 . . . . 74.140000000000001 109.091 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . 0.47 ' CG ' ' HE ' ' A' ' 450' ' ' ARG . 8.6 m-20 -104.95 143.65 32.87 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 107.545 -1.279 . . . . 72.340000000000003 107.545 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -151.67 148.53 28.05 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 108.737 -0.838 . . . . 61.119999999999997 108.737 175.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . 0.413 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 70.1 m-85 -122.43 127.82 50.12 Favored 'General case' 0 C--N 1.282 -2.367 0 N-CA-C 108.692 -0.855 . . . . 73.349999999999994 108.692 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.6 mt -124.7 128.23 73.26 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 N-CA-C 109.053 -0.721 . . . . 72.239999999999995 109.053 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 446' ' ' CYS . 35.6 tt0 -102.55 123.82 46.98 Favored 'General case' 0 C--N 1.282 -2.363 0 N-CA-C 109.485 -0.561 . . . . 74.319999999999993 109.485 177.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.459 ' HE2' ' HB3' ' A' ' 500' ' ' ARG . 80.4 mtp -96.97 171.63 8.37 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.537 -0.756 . . . . 73.420000000000002 109.092 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -74.69 -38.29 62.43 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 121.284 0.564 . . . . 53.100000000000001 110.074 -177.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . 0.422 ' HB2' ' HD3' ' A' ' 500' ' ' ARG . 1.7 m -115.63 141.12 48.49 Favored 'General case' 0 N--CA 1.403 -2.776 0 CA-C-N 115.432 -0.803 . . . . 71.540000000000006 110.039 -172.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -75.75 -25.04 56.16 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.334 0.587 . . . . 74.239999999999995 110.795 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.6 -40.9 55.74 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.603 -0.726 . . . . 74.299999999999997 109.45 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . 0.459 ' HB3' ' HE2' ' A' ' 495' ' ' MET . 8.7 mpt_? -63.16 -41.48 99.25 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.839 -1.073 . . . . 70.310000000000002 110.647 174.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -59.82 -44.03 94.25 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.503 0.502 . . . . 73.409999999999997 110.685 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 75.430000000000007 110.468 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 4.2 tpt -62.62 -41.62 99.12 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.005 -0.543 . . . . 75.519999999999996 109.845 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.37 -39.9 89.4 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.305 -0.407 . . . . 72.219999999999999 110.927 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.53 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -72.57 -22.87 60.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.345 -0.389 . . . . 64.5 111.912 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -82.57 -44.6 15.66 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 109.024 -0.732 . . . . 71.319999999999993 109.024 176.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.88 -43.24 96.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.722 -1.126 . . . . 71.439999999999998 110.045 -178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 62.8 m -101.6 13.68 34.22 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 115.208 -0.905 . . . . 54.119999999999997 112.985 -175.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . 0.53 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 25.3 t-80 -68.47 92.19 0.43 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.911 -0.774 . . . . 54.420000000000002 108.911 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.474 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 81.1 tttt 67.46 70.46 0.36 Allowed 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.871 1.668 . . . . 75.109999999999999 109.637 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 87.1 tttt -105.21 148.08 27.32 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 113.274 -1.785 . . . . 51.200000000000003 108.363 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -84.3 117.61 23.67 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.85 -0.74 . . . . 73.439999999999998 109.623 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.446 ' SD ' HG21 ' A' ' 518' ' ' VAL . 26.3 ttt -108.37 95.37 5.62 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 106.935 -1.506 . . . . 63.520000000000003 106.935 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt 69.57 -79.39 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.335 1.022 . . . . 73.519999999999996 111.123 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -135.23 -3.65 2.43 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.944 0.878 . . . . 73.019999999999996 110.65 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -109.83 162.1 14.81 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.693 -0.855 . . . . 75.140000000000001 108.693 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -112.62 117.7 33.01 Favored 'General case' 0 N--CA 1.426 -1.653 0 N-CA-C 108.277 -1.009 . . . . 65.420000000000002 108.277 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . 0.446 HG21 ' SD ' ' A' ' 513' ' ' MET . 95.2 t -106.46 122.12 59.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.887 0 CA-C-N 114.901 -1.045 . . . . 73.230000000000004 108.563 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . 0.474 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 39.3 tt0 -99.2 114.35 27.1 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 108.434 -0.95 . . . . 71.209999999999994 108.434 -178.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 92.6 t -104.87 136.09 40.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 CA-C-N 114.998 -1.001 . . . . 62.009999999999998 109.777 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -135.29 141.86 45.76 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.514 -0.921 . . . . 72.010000000000005 108.514 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -76.66 154.69 34.03 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 109.452 -0.573 . . . . 72.329999999999998 109.452 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.8 m -152.36 169.28 22.92 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.291 0.567 . . . . 75.319999999999993 109.535 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 76.4 p -104.35 164.92 11.4 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 108.178 -1.045 . . . . 72.140000000000001 108.178 176.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -54.71 -39.06 67.8 Favored 'General case' 0 C--N 1.307 -1.265 0 O-C-N 123.734 0.646 . . . . 73.439999999999998 110.363 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -62.93 -47.19 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.949 -0.569 . . . . 71.120000000000005 110.567 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -63.21 -37.16 86.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.374 -0.376 . . . . 73.340000000000003 111.446 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . 0.42 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.3 ttt -62.79 -48.37 79.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.923 -0.58 . . . . 51.409999999999997 110.314 177.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -68.36 -34.68 76.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.3 0.571 . . . . 73.140000000000001 109.994 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.29 -41.51 96.84 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.26 -0.882 . . . . 74.129999999999995 110.906 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 62.7 t -75.98 -35.0 28.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 C-N-CA 119.709 -0.796 . . . . 63.009999999999998 110.293 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 528' ' ' MET . 91.4 mt -67.76 -34.86 77.64 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 116.318 -0.401 . . . . 70.519999999999996 111.483 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 26.0 ttt -78.62 -18.25 54.8 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 122.036 0.922 . . . . 73.510000000000005 110.565 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 75.94 53.68 5.67 Favored Glycine 0 C--N 1.278 -2.663 0 CA-C-N 114.137 -1.392 . . . . 64.319999999999993 111.026 -176.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -64.0 164.48 31.95 Favored Glycine 0 N--CA 1.422 -2.282 0 CA-C-N 115.334 -0.433 . . . . 65.329999999999998 113.087 178.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 m -74.18 116.02 14.34 Favored 'General case' 0 N--CA 1.431 -1.379 0 C-N-CA 122.8 0.44 . . . . 75.209999999999994 110.342 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 61.4 tp -117.62 114.55 23.56 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 108.323 -0.991 . . . . 73.510000000000005 108.323 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -79.18 119.51 22.37 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 122.24 1.019 . . . . 75.420000000000002 112.052 -176.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 19.7 ttm180 -141.8 102.77 4.23 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 114.805 -1.089 . . . . 75.230000000000004 108.312 175.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.43 75.59 4.95 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 122.923 1.344 . . . . 73.239999999999995 111.567 177.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.43 -1.437 0 N-CA-C 106.605 -1.628 . . . . 73.099999999999994 106.605 -175.714 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.502 0 N-CA-C 107.75 -1.204 . . . . 71.519999999999996 107.75 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 440' ' ' PRO . 15.0 Cg_endo -59.13 137.66 80.58 Favored 'Trans proline' 0 C--O 1.241 0.648 0 C-N-CA 122.006 1.804 . . . . 64.510000000000005 110.611 176.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 439' ' ' PRO . 36.9 Cg_exo -58.32 111.95 1.02 Allowed 'Trans proline' 0 C--O 1.248 1.01 0 C-N-CA 122.444 2.096 . . . . 73.109999999999999 111.96 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.7 m -67.71 105.37 1.89 Allowed 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.763 -0.653 . . . . 73.239999999999995 109.341 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . 0.473 ' HB2' ' HB3' ' A' ' 525' ' ' ALA . 7.9 p30 -124.99 160.3 29.29 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.17 -0.678 . . . . 72.219999999999999 109.17 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 12.9 t -117.45 165.47 12.77 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 N-CA-C 107.692 -1.225 . . . . 75.129999999999995 107.692 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.588 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 63.7 mtm180 -85.12 66.96 10.01 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.822 0.82 . . . . 71.319999999999993 110.735 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -106.41 7.64 31.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.031 -0.986 . . . . 71.129999999999995 111.179 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.477 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 18.4 m -106.24 137.08 44.83 Favored 'General case' 0 N--CA 1.416 -2.142 0 C-N-CA 119.445 -0.902 . . . . 74.340000000000003 108.874 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -115.54 132.57 64.53 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.265 0 N-CA-C 107.557 -1.275 . . . . 55.219999999999999 107.557 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.29 125.56 50.65 Favored 'General case' 0 C--N 1.274 -2.716 0 N-CA-C 108.213 -1.032 . . . . 74.540000000000006 108.213 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 17.7 mt -105.33 143.65 33.21 Favored 'General case' 0 C--N 1.275 -2.646 0 N-CA-C 105.913 -1.884 . . . . 75.510000000000005 105.913 178.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . 0.417 ' HD3' ' OE1' ' A' ' 519' ' ' GLU . 49.2 ttt180 -152.62 141.28 20.9 Favored 'General case' 0 C--N 1.289 -2.023 0 C-N-CA 120.907 -0.317 . . . . 74.120000000000005 110.16 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 85.05 23.6 48.24 Favored Glycine 0 C--N 1.311 -0.827 0 N-CA-C 110.615 -0.994 . . . . 71.140000000000001 110.615 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.08 151.07 67.8 Favored Pre-proline 0 C--O 1.244 0.776 0 C-N-CA 123.974 0.91 . . . . 71.209999999999994 112.998 -176.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -61.45 151.91 76.53 Favored 'Trans proline' 0 N--CA 1.442 -1.509 0 C-N-CA 122.853 2.369 . . . . 72.219999999999999 110.642 173.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -77.68 92.23 4.11 Favored 'General case' 0 C--N 1.275 -2.634 0 CA-C-N 114.817 -1.083 . . . . 73.400000000000006 110.035 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.22 36.07 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.022 0 CA-C-N 112.226 -2.261 . . . . 43.409999999999997 112.456 174.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.66 124.49 19.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 107.717 -1.216 . . . . 65.439999999999998 107.717 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 8.6 p -76.13 150.27 37.24 Favored 'General case' 0 N--CA 1.399 -3.012 0 N-CA-C 109.123 -0.695 . . . . 65.430000000000007 109.123 -175.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.276 2.4 pp -61.7 -30.73 48.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 114.277 1.214 . . . . 70.430000000000007 114.277 -173.133 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . 0.432 ' N ' HD12 ' A' ' 458' ' ' ILE . 0.0 OUTLIER -81.56 -22.27 37.91 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.542 -0.863 . . . . 72.409999999999997 110.04 -177.7 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 20.6 t70 -75.67 -40.23 56.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.162 -0.926 . . . . 75.0 109.177 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 13.7 tt -76.0 -32.28 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 115.214 -0.903 . . . . 71.209999999999994 110.263 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 84.4 mt -72.14 -29.42 64.03 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.348 -0.612 . . . . 75.129999999999995 109.348 176.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 25.8 t70 -63.16 -53.39 54.1 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-N 115.324 -0.853 . . . . 61.43 108.784 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.81 -42.04 64.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 114.539 -1.21 . . . . 73.230000000000004 111.435 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.94 -37.16 78.7 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.828 -0.624 . . . . 53.32 110.982 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 77.36 -140.56 24.68 Favored Glycine 0 N--CA 1.421 -2.32 0 C-N-CA 120.42 -0.895 . . . . 71.120000000000005 112.153 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -48.63 -32.08 7.69 Favored 'General case' 0 C--N 1.291 -1.971 0 C-N-CA 126.238 1.815 . . . . 61.43 113.137 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -66.61 -23.44 66.18 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.965 0.412 . . . . 74.420000000000002 111.393 -177.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.93 -15.48 60.69 Favored 'General case' 0 C--O 1.206 -1.201 0 CA-C-N 116.136 -0.484 . . . . 63.439999999999998 111.532 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.8 m -78.08 -16.83 57.67 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-O 121.389 0.614 . . . . 75.319999999999993 110.387 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . 0.419 ' OD1' ' HB3' ' A' ' 495' ' ' MET . 11.7 t70 -84.69 -11.9 54.94 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 116.274 -0.421 . . . . 73.430000000000007 111.431 -175.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.1 tt -52.39 145.78 2.53 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 124.194 0.998 . . . . 71.120000000000005 111.889 -176.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . 0.423 ' O ' HG12 ' A' ' 472' ' ' ILE . 84.8 mtt180 -75.46 158.06 33.16 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.066 -1.087 . . . . 73.25 108.066 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 7.7 t -57.82 110.45 0.91 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-O 121.416 0.627 . . . . 72.209999999999994 111.065 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 62.29 27.01 16.18 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.57 1.148 . . . . 75.400000000000006 111.088 -176.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.63 19.11 2.06 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 115.276 0.87 . . . . 54.299999999999997 115.276 -176.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.5 p -93.61 110.6 23.6 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-O 121.536 0.684 . . . . 72.409999999999997 109.714 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -108.85 94.91 5.3 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.571 -1.27 . . . . 71.150000000000006 107.571 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . 0.544 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 53.6 ttm -87.67 139.31 30.66 Favored 'General case' 0 C--N 1.287 -2.133 0 C-N-CA 120.394 -0.522 . . . . 53.409999999999997 109.73 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 66.3 t -81.67 97.85 3.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 N-CA-C 108.826 -0.805 . . . . 74.140000000000001 108.826 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.4 mt -97.26 154.02 17.67 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.369 -1.287 . . . . 73.510000000000005 107.83 178.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -93.32 173.44 7.71 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.391 -1.707 . . . . 74.340000000000003 106.391 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -59.35 -27.51 66.0 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 119.279 0.945 . . . . 74.109999999999999 111.724 -176.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -70.37 -11.84 61.18 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.746 0.819 . . . . 75.219999999999999 111.155 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 82.5 29.03 37.39 Favored Glycine 0 N--CA 1.432 -1.6 0 CA-C-N 116.131 -0.486 . . . . 32.43 112.412 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -123.1 140.24 33.18 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 108.437 -0.949 . . . . 71.450000000000003 108.437 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . 0.544 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 29.7 Cg_endo -63.51 134.23 43.63 Favored 'Trans proline' 0 C--O 1.242 0.707 0 C-N-CA 122.906 2.404 . . . . 64.030000000000001 113.727 -177.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 17.7 m -76.31 -18.58 58.88 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.735 0.779 . . . . 64.239999999999995 109.796 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 106.7 15.85 15.75 Favored Glycine 0 CA--C 1.497 -1.084 0 N-CA-C 111.172 -0.771 . . . . 71.530000000000001 111.172 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -127.42 151.85 48.28 Favored 'General case' 0 C--O 1.256 1.433 0 N-CA-C 105.412 -2.07 . . . . 61.350000000000001 105.412 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -165.21 153.95 12.09 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 118.153 0.433 . . . . 51.520000000000003 110.062 -177.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -125.69 120.13 29.85 Favored 'General case' 0 C--N 1.288 -2.101 0 N-CA-C 108.669 -0.863 . . . . 75.109999999999999 108.669 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 56.7 mt -107.66 130.18 60.42 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.53 0 N-CA-C 107.059 -1.459 . . . . 61.450000000000003 107.059 176.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.477 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 9.3 tt0 -104.5 116.98 33.04 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.155 0.503 . . . . 75.409999999999997 110.155 -177.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.419 ' HB3' ' OD1' ' A' ' 471' ' ' ASP . 0.3 OUTLIER -92.79 172.59 8.25 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.197 -0.91 . . . . 72.219999999999999 110.192 178.09 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.407 ' HG2' ' HG2' ' A' ' 473' ' ' ARG . 36.0 mtmm -88.16 -35.28 17.49 Favored 'General case' 0 N--CA 1.394 -3.253 0 CA-C-N 116.21 -0.45 . . . . 72.209999999999994 110.472 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.4 m -116.25 141.12 48.56 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-O 121.526 0.679 . . . . 44.100000000000001 112.085 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -73.03 -16.12 61.5 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.202 -0.908 . . . . 70.439999999999998 110.969 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -62.03 -56.38 19.57 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.654 -0.703 . . . . 75.209999999999994 109.686 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.27 70.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.082 -0.963 . . . . 71.010000000000005 111.243 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.17 -42.76 83.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.11 -0.496 . . . . 72.219999999999999 110.71 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -66.69 -44.48 81.62 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.072 0.463 . . . . 73.409999999999997 110.287 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 38.5 tpp -71.14 -33.32 69.96 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.75 -0.659 . . . . 74.5 110.991 -175.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.36 -40.55 81.43 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 109.647 -0.501 . . . . 71.109999999999999 109.647 176.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -69.41 -30.19 68.09 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.962 -0.563 . . . . 62.020000000000003 111.537 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -76.34 -40.78 50.4 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 120.811 -0.356 . . . . 74.239999999999995 110.509 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -69.88 -43.3 72.1 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.278 0.561 . . . . 55.409999999999997 110.63 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 61.0 m -99.35 16.75 22.03 Favored 'General case' 0 N--CA 1.415 -2.201 0 N-CA-C 113.529 0.937 . . . . 44.049999999999997 113.529 -173.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . 0.425 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 10.9 t-80 -66.68 91.76 0.2 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.303 -0.559 . . . . 75.010000000000005 110.158 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 99.4 mttt 67.93 35.74 3.69 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 125.037 1.335 . . . . 52.140000000000001 110.758 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -80.35 147.77 30.93 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.614 -1.175 . . . . 74.129999999999995 109.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.49 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 13.8 m120 -74.72 120.3 20.08 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 115.724 -0.671 . . . . 74.25 110.311 178.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.1 ttt -102.15 93.16 5.08 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 106.088 -1.819 . . . . 74.140000000000001 106.088 175.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 67.71 -77.38 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 124.297 1.039 . . . . 73.140000000000001 111.185 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -125.38 -18.49 5.31 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-O 121.811 0.815 . . . . 74.420000000000002 110.713 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 22.7 tpt180 -90.79 160.86 15.56 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.253 -0.885 . . . . 75.420000000000002 109.956 -170.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -113.91 116.26 28.99 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.29 -1.744 . . . . 74.540000000000006 106.29 172.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 92.9 t -110.86 122.0 64.57 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.921 0 CA-C-N 116.33 -0.396 . . . . 63.420000000000002 109.946 -176.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . 0.417 ' OE1' ' HD3' ' A' ' 450' ' ' ARG . 41.7 tt0 -85.71 109.46 18.63 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 107.891 -1.151 . . . . 75.230000000000004 107.891 176.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' A' ' 505' ' ' ALA . 97.5 t -105.02 124.65 59.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.295 -1.372 . . . . 52.109999999999999 107.295 176.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -133.4 138.28 46.2 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.44 -0.948 . . . . 51.109999999999999 108.44 -173.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . 0.415 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 46.4 tt0 -83.16 153.25 24.88 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.626 -0.509 . . . . 73.409999999999997 109.626 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . 0.415 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 5.9 p -162.66 171.5 16.79 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 122.769 0.428 . . . . 74.420000000000002 110.004 -177.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.588 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 1.3 m -97.59 160.47 14.3 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.7 -0.682 . . . . 73.349999999999994 109.429 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . 0.473 ' HB3' ' HB2' ' A' ' 442' ' ' ASN . . . -59.88 -21.71 61.38 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.629 -0.714 . . . . 71.420000000000002 111.535 177.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.39 -54.1 23.46 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 116.343 -0.39 . . . . 72.030000000000001 110.372 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -38.51 82.7 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 110.215 -0.291 . . . . 75.310000000000002 110.215 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -59.35 -44.77 92.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.857 -0.61 . . . . 72.409999999999997 110.445 177.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -69.32 -40.67 77.49 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.315 0.579 . . . . 71.530000000000001 109.567 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -59.62 -44.53 93.42 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.221 -0.899 . . . . 54.310000000000002 111.271 -178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.4 t -73.65 -34.6 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 120.38 -0.528 . . . . 61.039999999999999 110.377 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.99 -21.91 62.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 74.329999999999998 111.443 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 65.5 mtm -88.49 -0.49 57.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.187 0.518 . . . . 73.329999999999998 111.153 176.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 74.69 27.25 65.45 Favored Glycine 0 C--N 1.301 -1.391 0 CA-C-N 115.242 -0.89 . . . . 64.239999999999995 112.77 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -69.11 140.28 33.91 Favored Glycine 0 N--CA 1.416 -2.683 0 N-CA-C 111.685 -0.566 . . . . 72.409999999999997 111.685 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 28.5 m -151.89 129.61 11.59 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.387 -0.968 . . . . 61.130000000000003 108.387 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 91.1 mt -80.12 97.28 6.79 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.275 -1.009 . . . . 74.319999999999993 108.275 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -90.19 65.04 6.28 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-O 122.674 1.226 . . . . 71.120000000000005 112.682 -176.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -140.26 94.47 2.75 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 106.763 -1.569 . . . . 71.209999999999994 106.763 174.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -155.13 137.64 15.06 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.246 -0.888 . . . . 60.210000000000001 110.444 -175.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 . . . . . 0 C--N 1.299 -1.621 0 N-CA-C 107.993 -1.114 . . . . 73.310000000000002 107.993 179.391 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . 0.439 ' SD ' HG21 ' A' ' 443' ' ' VAL . 19.9 ptp . . . . . 0 CA--C 1.515 -0.385 0 N-CA-C 108.717 -0.846 . . . . 54.210000000000001 108.717 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -82.31 167.93 15.24 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 121.83 1.686 . . . . 75.239999999999995 108.714 171.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.34 105.52 0.15 Allowed 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.685 2.257 . . . . 65.099999999999994 111.413 178.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.4 m -142.3 159.37 42.37 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 107.771 -1.196 . . . . 64.349999999999994 107.771 -175.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . 0.412 ' OD1' ' HB2' ' A' ' 524' ' ' SER . 49.3 t30 -82.71 111.94 19.11 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.467 -0.938 . . . . 72.519999999999996 108.467 175.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . 0.439 HG21 ' SD ' ' A' ' 438' ' ' MET . 47.5 t -108.85 144.54 17.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 N-CA-C 109.672 -0.492 . . . . 72.219999999999999 109.672 -176.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.538 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 19.8 ptt85 -92.35 65.72 4.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.168 0.985 . . . . 74.219999999999999 111.401 177.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 33.2 p30 -112.75 12.11 19.55 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.294 -0.866 . . . . 74.409999999999997 110.408 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 30.7 m -109.18 145.77 35.25 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 108.752 -0.833 . . . . 62.130000000000003 108.752 -177.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.72 140.07 49.99 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.111 0 N-CA-C 108.248 -1.019 . . . . 55.25 108.248 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -111.6 121.69 45.83 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.07 -1.085 . . . . 70.409999999999997 108.07 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.9 mt -103.41 132.18 49.88 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 106.488 -1.671 . . . . 75.430000000000007 106.488 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -126.86 136.61 52.58 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 118.419 0.554 . . . . 55.350000000000001 109.621 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 516' ' ' ARG . . . 96.09 38.86 4.46 Favored Glycine 0 C--N 1.31 -0.885 0 C-N-CA 120.489 -0.862 . . . . 41.219999999999999 111.654 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 96.1 mt -83.54 144.33 45.78 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.991 -0.374 . . . . 70.439999999999998 109.991 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.472 ' HB2' ' HB2' ' A' ' 456' ' ' ALA . 31.8 Cg_exo -50.15 143.96 24.0 Favored 'Trans proline' 0 C--O 1.253 1.266 0 C-N-CA 123.113 2.542 . . . . 62.530000000000001 111.065 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -70.88 92.6 0.92 Allowed 'General case' 0 N--CA 1.417 -2.081 0 CA-C-O 122.402 1.096 . . . . 74.140000000000001 111.469 -177.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.87 33.62 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 111.162 -2.744 . . . . 33.130000000000003 112.415 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 453' ' ' PRO . . . -56.01 138.42 49.16 Favored 'General case' 0 C--O 1.246 0.883 0 N-CA-C 109.44 -0.578 . . . . 40.439999999999998 109.44 171.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 28.4 p -78.06 160.22 28.23 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 116.42 -0.354 . . . . 63.420000000000002 111.02 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.472 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 65.4 mt -65.34 -31.93 56.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.262 0.554 . . . . 63.100000000000001 109.601 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -64.01 -40.2 95.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.052 0.453 . . . . 54.310000000000002 110.249 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -70.16 -37.83 75.29 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.428 -0.806 . . . . 73.109999999999999 110.161 -176.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.421 HG22 ' HA ' ' A' ' 458' ' ' ILE . 13.4 tt -74.59 -32.01 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.027 -0.533 . . . . 75.109999999999999 110.651 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -67.31 -35.38 79.32 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.451 0.643 . . . . 53.43 110.001 176.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -65.13 -49.02 71.51 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.621 -0.881 . . . . 64.349999999999994 108.621 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -53.73 -41.92 67.58 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 113.894 -1.503 . . . . 75.129999999999995 111.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.88 -36.68 84.72 Favored 'General case' 0 C--O 1.248 0.998 0 CA-C-N 116.129 -0.487 . . . . 74.430000000000007 111.718 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 84.11 -143.18 21.06 Favored Glycine 0 N--CA 1.422 -2.29 0 C-N-CA 120.099 -1.048 . . . . 61.210000000000001 111.706 -178.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -54.52 -34.27 61.43 Favored 'General case' 0 C--N 1.3 -1.561 0 C-N-CA 123.527 0.731 . . . . 65.219999999999999 111.066 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . 0.411 ' O ' ' HE1' ' A' ' 495' ' ' MET . 95.0 m-85 -61.3 -17.45 53.71 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.559 -0.746 . . . . 73.140000000000001 112.599 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . 0.473 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -68.25 -15.29 63.52 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 120.836 0.35 . . . . 52.340000000000003 111.397 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 17.3 m -84.77 -20.53 30.88 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-O 121.894 0.854 . . . . 52.450000000000003 109.194 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -107.43 15.52 24.8 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.362 -0.835 . . . . 70.040000000000006 112.365 -174.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . 0.473 HG22 ' O ' ' A' ' 469' ' ' ALA . 11.6 tt -82.55 151.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 106.316 -1.735 . . . . 65.0 106.316 170.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 20.8 mtm-85 -100.3 153.76 19.04 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 118.975 -1.09 . . . . 61.140000000000001 111.128 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 10.0 t -62.58 136.27 57.81 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.566 -0.901 . . . . 71.230000000000004 108.566 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 67.9 22.83 8.54 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 122.294 1.045 . . . . 72.219999999999999 109.376 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -88.08 -20.46 49.54 Favored Glycine 0 N--CA 1.423 -2.224 0 C-N-CA 120.701 -0.762 . . . . 62.520000000000003 112.853 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 47.8 t -89.66 115.19 28.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 117.011 0.406 . . . . 63.210000000000001 110.988 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -127.65 98.09 5.08 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.881 -0.785 . . . . 75.219999999999999 108.881 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 86.0 mtp -83.9 139.44 32.61 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.849 -0.426 . . . . 62.210000000000001 109.849 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 43.0 t -84.04 97.98 5.33 Favored 'Isoleucine or valine' 0 C--O 1.251 1.171 0 CA-C-O 121.553 0.692 . . . . 71.140000000000001 109.728 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 65.2 mt -86.14 155.95 20.55 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.885 -1.154 . . . . 71.519999999999996 107.885 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -96.26 -178.67 4.39 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.583 -1.636 . . . . 72.329999999999998 106.583 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 47.5 m-70 -65.62 -9.81 30.21 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 119.022 0.828 . . . . 74.340000000000003 112.235 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . 0.436 ' OE1' ' HD3' ' A' ' 486' ' ' ARG . 35.2 tt0 -81.38 -12.79 58.86 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 123.855 0.862 . . . . 53.439999999999998 108.877 176.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 75.33 29.19 60.49 Favored Glycine 0 CA--C 1.494 -1.242 0 CA-C-N 115.275 -0.875 . . . . 62.329999999999998 111.373 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.436 ' HD3' ' OE1' ' A' ' 484' ' ' GLN . 62.1 mtp85 -133.16 147.96 67.29 Favored Pre-proline 0 C--N 1.308 -1.238 0 N-CA-C 107.945 -1.132 . . . . 63.229999999999997 107.945 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -54.93 134.47 63.57 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 123.734 2.956 . . . . 53.140000000000001 115.061 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.7 m -75.48 -33.98 60.86 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.176 -0.92 . . . . 31.43 108.884 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 137.16 -16.35 3.66 Favored Glycine 0 CA--C 1.493 -1.309 0 N-CA-C 110.806 -0.917 . . . . 54.210000000000001 110.806 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -116.4 158.7 23.09 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-O 121.021 0.439 . . . . 63.25 110.554 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.33 167.69 29.54 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.687 -0.688 . . . . 55.030000000000001 109.53 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -120.08 145.2 47.1 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.064 -0.717 . . . . 72.340000000000003 109.064 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 46.5 mt -133.44 131.89 57.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 N-CA-C 107.665 -1.235 . . . . 74.239999999999995 107.665 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -106.47 124.47 49.65 Favored 'General case' 0 C--N 1.284 -2.269 0 CA-C-O 121.477 0.655 . . . . 74.450000000000003 109.997 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.411 ' HE1' ' O ' ' A' ' 468' ' ' PHE . 96.3 mmm -98.08 170.05 9.18 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.79 -1.095 . . . . 72.109999999999999 110.994 -175.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -65.3 -46.39 80.58 Favored 'General case' 0 C--N 1.28 -2.432 0 C-N-CA 125.894 1.678 . . . . 55.219999999999999 111.738 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.7 m -130.22 142.61 50.55 Favored 'General case' 0 N--CA 1.408 -2.545 0 N-CA-C 108.617 -0.883 . . . . 55.140000000000001 108.617 -172.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.83 74.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.97 0.89 . . . . 75.120000000000005 111.126 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.84 -46.1 66.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 114.294 -1.321 . . . . 74.239999999999995 110.17 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -62.28 -38.26 88.66 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.821 -1.081 . . . . 72.209999999999994 110.293 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.34 -37.93 88.59 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.393 -0.821 . . . . 41.229999999999997 111.204 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.71 -41.46 83.51 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 110.045 -0.354 . . . . 61.219999999999999 110.045 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 54.8 ttm -67.81 -38.93 83.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.301 -0.408 . . . . 62.200000000000003 110.224 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.23 86.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.97 -0.559 . . . . 64.430000000000007 110.354 177.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.03 84.32 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.979 -0.555 . . . . 54.340000000000003 110.894 177.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -64.83 -42.09 95.22 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.702 -0.481 . . . . 74.120000000000005 109.702 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.05 -45.29 94.2 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.411 0.624 . . . . 65.510000000000005 111.105 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.7 m -94.45 6.75 47.81 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 112.848 0.684 . . . . 61.119999999999997 112.848 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -76.05 108.35 8.9 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.342 -0.849 . . . . 71.109999999999999 108.792 175.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.433 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 44.0 mttp 72.8 17.32 4.39 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.233 1.013 . . . . 64.349999999999994 112.066 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.17 138.27 36.84 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 115.894 -0.593 . . . . 73.340000000000003 109.801 -178.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -76.11 136.08 39.85 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 115.038 -0.983 . . . . 63.340000000000003 111.994 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.4 ttt -129.8 103.25 6.7 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 105.519 -2.03 . . . . 73.25 105.519 175.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 71.3 -78.89 0.04 OUTLIER 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.708 1.203 . . . . 63.210000000000001 110.698 -175.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -138.63 -14.79 1.23 Allowed 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.579 0.704 . . . . 64.010000000000005 111.843 176.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 451' ' ' GLY . 0.4 OUTLIER -92.23 156.46 17.28 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.891 -1.151 . . . . 64.530000000000001 107.891 -175.22 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -109.66 118.84 37.62 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-O 121.492 0.663 . . . . 73.019999999999996 109.321 173.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.9 t -92.35 131.23 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.262 0 N-CA-C 107.855 -1.165 . . . . 73.319999999999993 107.855 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . 0.433 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 42.7 mt-10 -104.94 113.6 27.3 Favored 'General case' 0 N--CA 1.413 -2.31 0 N-CA-C 108.997 -0.742 . . . . 72.219999999999999 108.997 175.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 76.0 t -104.08 129.77 55.78 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.606 -1.179 . . . . 71.409999999999997 111.196 -177.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -127.57 141.94 51.5 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.281 -0.872 . . . . 73.430000000000007 109.076 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -84.0 151.92 24.73 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 117.958 0.345 . . . . 73.219999999999999 111.509 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.4 p -155.31 173.23 16.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 123.621 0.768 . . . . 62.530000000000001 109.746 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.5 p -102.13 159.59 15.25 Favored 'General case' 0 C--N 1.284 -2.266 0 N-CA-C 112.705 0.631 . . . . 71.409999999999997 112.705 -179.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -55.34 -37.62 67.69 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 123.871 0.869 . . . . 41.329999999999998 112.086 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.94 -35.64 81.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.997 -0.547 . . . . 75.150000000000006 110.713 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.73 -39.77 84.25 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 123.345 0.403 . . . . 61.109999999999999 110.568 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . 0.544 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 42.6 ttm -59.58 -48.45 81.6 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.181 -0.674 . . . . 55.399999999999999 109.181 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.38 -35.49 80.56 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.069 -0.969 . . . . 74.439999999999998 110.203 -179.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -65.76 -42.3 91.02 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.657 -0.701 . . . . 54.409999999999997 110.153 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 88.1 t -72.58 -34.14 46.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 120.932 0.396 . . . . 71.239999999999995 110.5 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.9 mt -67.5 -35.51 79.29 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.187 0.518 . . . . 50.140000000000001 110.061 176.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 26.3 ttt -73.16 -18.44 61.27 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 122.104 0.954 . . . . 74.329999999999998 111.023 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 83.34 22.75 56.15 Favored Glycine 0 C--N 1.273 -2.968 0 CA-C-N 114.16 -1.382 . . . . 62.020000000000003 111.963 -177.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -64.69 136.07 38.6 Favored Glycine 0 N--CA 1.413 -2.874 0 N-CA-C 110.654 -0.978 . . . . 43.140000000000001 110.654 178.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 8.6 m -77.54 118.05 19.58 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-O 121.352 0.596 . . . . 63.210000000000001 110.361 -176.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 63.1 tp -111.59 94.36 4.92 Favored 'General case' 0 C--N 1.282 -2.359 0 N-CA-C 106.7 -1.593 . . . . 72.310000000000002 106.7 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -131.11 174.24 10.22 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 109.032 -0.729 . . . . 50.520000000000003 109.032 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 64.83 57.87 1.0 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 125.188 1.395 . . . . 72.340000000000003 109.611 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 91.0 mt -119.17 112.73 19.87 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.144 -0.935 . . . . 74.219999999999999 109.29 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 . . . . . 0 C--N 1.3 -1.583 0 N-CA-C 109.466 -0.568 . . . . 75.439999999999998 109.466 -178.704 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.496 -1.101 0 N-CA-C 108.58 -0.896 . . . . 65.5 108.58 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -70.54 150.36 63.35 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 121.529 1.486 . . . . 72.140000000000001 110.192 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.85 -17.13 29.24 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 121.791 1.66 . . . . 75.120000000000005 110.632 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 27.4 m -115.7 105.37 12.66 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 114.945 -1.025 . . . . 52.439999999999998 108.843 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -110.27 141.2 43.57 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 109.27 -0.641 . . . . 72.209999999999994 109.27 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -98.54 163.58 2.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 N-CA-C 108.536 -0.913 . . . . 62.409999999999997 108.536 -175.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.597 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 26.7 mtp180 -90.82 73.8 6.57 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-O 121.846 0.832 . . . . 75.430000000000007 109.72 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 26.4 p-10 -114.68 14.06 17.48 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 115.011 -0.995 . . . . 71.25 109.87 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 25.4 m -116.3 149.66 38.91 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 107.628 -1.249 . . . . 75.329999999999998 107.628 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -124.34 139.33 50.98 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.449 0 N-CA-C 108.935 -0.765 . . . . 63.530000000000001 108.935 -177.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -109.97 123.49 49.75 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.083 -1.081 . . . . 64.209999999999994 108.083 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 18.2 mt -99.83 144.36 28.98 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 106.979 -1.489 . . . . 73.239999999999995 106.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -141.28 140.0 33.79 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.545 -0.909 . . . . 72.340000000000003 108.545 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 84.06 32.03 24.46 Favored Glycine 0 C--N 1.291 -1.948 0 C-N-CA 120.315 -0.945 . . . . 74.530000000000001 111.727 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.1 138.35 89.75 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 115.981 -0.109 . . . . 74.010000000000005 110.852 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -58.25 144.97 94.95 Favored 'Trans proline' 0 CA--C 1.486 -1.914 0 C-N-CA 122.549 2.166 . . . . 73.519999999999996 111.31 176.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -78.14 106.69 10.19 Favored 'General case' 1 N--CA 1.376 -4.144 0 N-CA-C 106.908 -1.516 . . . . 73.319999999999993 106.908 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.97 29.61 0.02 OUTLIER 'General case' 0 C--N 1.267 -2.986 0 CA-C-N 111.91 -2.404 . . . . 62.149999999999999 112.841 173.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -87.3 120.03 28.17 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.317 -1.364 . . . . 64.109999999999999 107.317 169.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . 0.581 ' HB ' ' OE1' ' A' ' 459' ' ' GLU . 20.1 p -74.39 157.24 36.02 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.389 0.138 . . . . 64.530000000000001 110.917 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.564 ' HA ' HG22 ' A' ' 461' ' ' ILE . 2.7 pp -65.34 -25.0 36.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 CA-C-O 121.19 0.519 . . . . 73.120000000000005 112.093 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . 0.581 ' OE1' ' HB ' ' A' ' 457' ' ' THR . 6.3 mp0 -68.21 -33.75 74.98 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.01 -0.737 . . . . 54.439999999999998 109.01 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -77.18 -34.1 56.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.21 -0.905 . . . . 50.140000000000001 109.646 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.564 HG22 ' HA ' ' A' ' 458' ' ' ILE . 13.4 tt -78.74 -32.2 15.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.983 0 C-N-CA 120.092 -0.643 . . . . 73.340000000000003 111.062 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.82 -30.82 71.1 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.939 -0.476 . . . . 72.219999999999999 110.866 175.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -63.79 -53.28 53.35 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.944 -1.132 . . . . 61.229999999999997 107.944 172.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 461' ' ' ILE . 80.1 t80 -51.92 -41.97 62.41 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 113.297 -1.774 . . . . 72.099999999999994 111.727 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 91.3 mt -64.65 -37.3 87.12 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.725 -0.67 . . . . 75.120000000000005 111.565 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 90.4 -141.85 16.08 Favored Glycine 0 N--CA 1.419 -2.496 0 C-N-CA 120.255 -0.974 . . . . 41.509999999999998 112.253 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -51.56 -27.88 12.26 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 124.852 1.261 . . . . 62.32 112.186 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -64.63 -13.53 54.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.591 . . . . 71.439999999999998 112.418 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -67.36 -19.92 65.49 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.105 0.478 . . . . 72.019999999999996 111.176 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.2 m -101.71 0.46 36.04 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-O 121.968 0.89 . . . . 63.020000000000003 109.811 176.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . 0.424 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 58.6 m-20 -108.56 6.14 25.72 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 121.816 -0.552 . . . . 63.100000000000001 112.333 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 495' ' ' MET . 7.6 tt -88.74 151.71 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.791 0 N-CA-C 107.61 -1.256 . . . . 43.310000000000002 107.61 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 42.5 ptt85 -78.02 161.88 27.15 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 118.48 -1.288 . . . . 63.299999999999997 109.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 32.7 m -66.69 115.87 6.99 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 115.589 -0.732 . . . . 74.310000000000002 110.483 -175.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 65.44 28.81 11.55 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.616 1.166 . . . . 74.319999999999993 109.741 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -80.0 8.22 52.01 Favored Glycine 0 N--CA 1.442 -0.902 0 CA-C-N 115.448 -0.796 . . . . 62.329999999999998 114.392 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.96 118.85 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.812 -0.811 . . . . 41.350000000000001 108.812 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -117.18 135.35 53.84 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 107.34 -1.356 . . . . 65.200000000000003 107.34 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 52.7 tpp -116.05 138.52 51.15 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 108.861 -0.792 . . . . 62.219999999999999 108.861 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.05 106.01 16.03 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.128 0 N-CA-C 108.327 -0.99 . . . . 43.450000000000003 108.327 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 60.1 mt -89.8 147.39 23.83 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 106.344 -1.725 . . . . 73.329999999999998 106.344 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -90.33 -169.38 2.39 Favored 'General case' 0 C--N 1.27 -2.882 0 CA-C-N 115.919 -0.582 . . . . 51.299999999999997 109.915 -176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -62.64 -29.06 70.34 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.526 0.679 . . . . 60.130000000000003 110.362 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -79.99 -7.0 58.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.542 -0.753 . . . . 74.310000000000002 110.55 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . 0.456 ' C ' ' HD2' ' A' ' 486' ' ' ARG . . . 79.36 21.88 66.22 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 116.263 -0.426 . . . . 71.030000000000001 113.075 176.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.456 ' HD2' ' C ' ' A' ' 485' ' ' GLY . 8.5 mpt_? -120.31 151.32 53.29 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 108.667 -0.864 . . . . 71.450000000000003 108.667 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.15 123.38 13.7 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.467 2.112 . . . . 72.310000000000002 112.574 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 13.0 m -74.92 -8.35 56.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.689 -0.687 . . . . 71.329999999999998 111.004 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 87.74 16.43 59.92 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.368 -1.093 . . . . 42.409999999999997 110.368 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -125.56 132.78 52.5 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 103.968 -2.605 . . . . 54.219999999999999 103.968 -178.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -148.56 167.08 26.34 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 118.381 0.537 . . . . 53.5 110.42 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 85.4 m-85 -135.48 120.59 18.82 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 123.231 0.612 . . . . 74.329999999999998 109.606 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 55.4 mt -110.54 131.96 60.23 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 N-CA-C 108.054 -1.091 . . . . 71.140000000000001 108.054 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -103.91 124.78 49.59 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 108.568 -0.901 . . . . 71.129999999999995 108.568 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.417 ' HA ' ' HA ' ' A' ' 472' ' ' ILE . 91.1 mmm -98.7 175.05 6.12 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.272 0.558 . . . . 73.25 111.304 -174.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -71.8 -34.77 69.66 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 124.933 1.293 . . . . 60.420000000000002 110.55 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 30.6 t -152.18 153.59 34.14 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 115.007 -0.997 . . . . 75.25 109.962 -172.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.2 75.36 Favored 'General case' 0 CA--C 1.508 -0.673 0 C-N-CA 123.814 0.846 . . . . 71.430000000000007 110.815 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -59.09 -48.23 82.37 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 122.488 1.137 . . . . 61.43 109.959 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . 0.424 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 1.5 mmp_? -65.7 -40.98 92.86 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 113.227 -1.806 . . . . 74.340000000000003 109.832 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.97 -40.99 87.59 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.281 -0.872 . . . . 73.319999999999993 110.581 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -66.12 -38.35 87.97 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.647 -0.706 . . . . 74.019999999999996 110.93 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 83.8 mtp -75.63 -36.31 60.24 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 119.482 -0.887 . . . . 64.019999999999996 110.965 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -66.22 -41.1 90.56 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.283 -0.417 . . . . 75.219999999999999 110.596 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.76 -36.18 80.06 Favored 'General case' 0 C--O 1.203 -1.371 0 CA-C-N 116.067 -0.515 . . . . 55.240000000000002 110.38 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -44.72 82.06 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.477 -0.329 . . . . 75.140000000000001 110.898 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -63.45 -43.55 97.07 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.668 0.605 . . . . 73.209999999999994 111.369 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 28.8 m -101.67 10.99 39.6 Favored 'General case' 0 N--CA 1.432 -1.354 0 N-CA-C 112.726 0.639 . . . . 54.049999999999997 112.726 -173.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . 0.47 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 44.0 t60 -70.4 97.56 1.29 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 119.853 -0.739 . . . . 75.329999999999998 109.206 176.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 66.4 66.24 0.47 Allowed 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 125.156 1.383 . . . . 74.120000000000005 110.203 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.3 tptt -112.79 140.81 47.26 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.323 -1.762 . . . . 72.430000000000007 108.818 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -86.32 132.46 33.97 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 120.211 -0.596 . . . . 72.409999999999997 110.596 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.3 ttt -118.26 88.66 2.96 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 106.13 -1.804 . . . . 72.209999999999994 106.13 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt 68.99 -83.52 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.059 -1.428 . . . . 74.010000000000005 113.01 -176.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -121.87 -9.77 8.76 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.393 0.616 . . . . 70.129999999999995 110.833 -173.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -115.24 156.65 24.99 Favored 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 108.518 -0.919 . . . . 71.450000000000003 108.518 -173.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -108.85 121.45 45.11 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 121.112 0.482 . . . . 73.129999999999995 109.787 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . 0.425 HG12 HG23 ' A' ' 520' ' ' VAL . 60.5 t -102.9 114.04 41.34 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.951 0 CA-C-N 114.53 -1.214 . . . . 74.430000000000007 108.153 -178.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -104.51 110.37 22.62 Favored 'General case' 0 C--N 1.279 -2.497 0 N-CA-C 107.625 -1.25 . . . . 65.420000000000002 107.625 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . 0.425 HG23 HG12 ' A' ' 518' ' ' VAL . 73.5 t -104.82 129.02 58.04 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 CA-C-N 115.709 -0.678 . . . . 63.420000000000002 111.336 -175.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -116.06 152.11 34.23 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.325 -0.991 . . . . 75.319999999999993 108.325 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -90.99 157.81 17.07 Favored 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 106.835 -1.542 . . . . 74.010000000000005 106.835 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -157.69 160.51 38.03 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.405 0.622 . . . . 71.420000000000002 112.422 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.597 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 38.1 t -86.09 150.83 24.16 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.727 -1.124 . . . . 71.400000000000006 109.037 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.01 -30.03 67.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.208 0.528 . . . . 72.439999999999998 110.189 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -65.85 -51.47 58.6 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.56 1.144 . . . . 75.129999999999995 109.572 176.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -64.81 -37.48 87.76 Favored 'General case' 0 C--N 1.297 -1.69 0 C-N-CA 126.067 1.747 . . . . 72.25 109.798 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . 0.441 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.2 ttt -67.03 -44.63 79.76 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.315 -0.857 . . . . 70.409999999999997 109.566 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -65.57 -38.11 88.6 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.874 -0.603 . . . . 61.43 109.779 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -59.31 -45.88 90.1 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.43 -0.805 . . . . 74.299999999999997 110.742 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 60.4 t -68.89 -39.65 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 120.18 -0.608 . . . . 74.510000000000005 110.326 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.5 mt -64.91 -28.67 69.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.489 . . . . 71.140000000000001 112.22 -178.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 24.3 mmt -83.86 15.78 3.14 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.049 0.388 . . . . 72.340000000000003 112.049 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 90.28 45.31 4.43 Favored Glycine 0 N--CA 1.428 -1.886 0 N-CA-C 110.935 -0.866 . . . . 32.399999999999999 110.935 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -66.51 130.67 31.75 Favored Glycine 0 N--CA 1.409 -3.108 0 CA-C-N 115.091 -0.554 . . . . 73.230000000000004 112.806 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 9.5 t -67.65 140.94 56.85 Favored 'General case' 0 N--CA 1.426 -1.647 0 N-CA-C 108.422 -0.955 . . . . 74.420000000000002 108.422 177.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 34.0 tp -116.66 76.4 1.03 Allowed 'General case' 0 C--N 1.292 -1.922 0 CA-C-O 121.986 0.898 . . . . 72.430000000000007 109.536 -178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -100.6 102.67 13.87 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 105.749 -1.945 . . . . 70.530000000000001 105.749 178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . 0.44 ' HD3' ' OE1' ' A' ' 541' ' ' GLU . 19.0 ptp180 -68.1 154.42 41.7 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 115.731 -0.668 . . . . 71.239999999999995 110.506 -176.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.1 tt -151.66 100.07 2.66 Favored 'General case' 0 N--CA 1.409 -2.502 0 N-CA-C 104.026 -2.583 . . . . 62.350000000000001 104.026 173.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . 0.44 ' OE1' ' HD3' ' A' ' 539' ' ' ARG . 13.7 pt-20 . . . . . 0 C--N 1.289 -2.025 0 CA-C-N 115.582 -0.735 . . . . 74.319999999999993 109.706 -177.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 CA--C 1.51 -0.593 0 N-CA-C 110.179 -0.304 . . . . 72.019999999999996 110.179 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.93 156.56 48.41 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.047 1.831 . . . . 75.329999999999998 110.124 173.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -53.82 160.51 5.65 Favored 'Trans proline' 0 C--O 1.255 1.35 0 C-N-CA 123.66 2.907 . . . . 72.530000000000001 113.506 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 18.7 m 67.55 77.07 0.27 Allowed 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.788 -1.096 . . . . 44.409999999999997 109.03 -175.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -82.97 119.46 24.47 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 114.718 -1.128 . . . . 72.150000000000006 109.553 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 36.6 t -92.8 161.01 2.62 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.741 0 N-CA-C 107.712 -1.218 . . . . 63.450000000000003 107.712 -178.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.57 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.6 mtm180 -88.1 75.76 8.63 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 108.507 -0.923 . . . . 72.439999999999998 108.507 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -116.18 11.17 15.12 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.173 -1.376 . . . . 75.400000000000006 112.196 -171.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 56.6 m -106.63 152.43 23.76 Favored 'General case' 0 N--CA 1.407 -2.575 0 C-N-CA 119.547 -0.861 . . . . 65.430000000000007 109.464 -176.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 492' ' ' PHE . 1.3 mt -122.26 140.13 47.09 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.109 0 N-CA-C 106.495 -1.669 . . . . 75.349999999999994 106.495 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . 0.54 ' HD3' ' NH2' ' A' ' 450' ' ' ARG . 20.1 ttm180 -115.4 125.45 53.17 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.052 -0.722 . . . . 61.409999999999997 109.052 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 8.7 mt -107.12 145.66 32.22 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 107.647 -1.242 . . . . 62.210000000000001 107.647 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . 0.54 ' NH2' ' HD3' ' A' ' 448' ' ' ARG . 2.7 ptp180 -149.31 130.81 14.82 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 121.08 0.467 . . . . 75.25 111.706 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 111.02 29.95 3.35 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.407 -0.815 . . . . 25.5 111.094 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 91.4 mt -70.6 133.12 86.93 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 111.665 0.246 . . . . 75.409999999999997 111.665 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.496 ' HA ' ' CZ ' ' A' ' 516' ' ' ARG . 31.3 Cg_exo -58.58 164.64 9.0 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 123.305 2.67 . . . . 72.349999999999994 113.389 175.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -77.47 100.15 5.91 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.964 -1.471 . . . . 70.140000000000001 108.179 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 88.61 32.62 0.02 OUTLIER 'General case' 0 C--N 1.277 -2.544 0 CA-C-N 111.756 -2.475 . . . . 73.120000000000005 111.421 173.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.85 113.62 3.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.024 -1.102 . . . . 61.5 108.024 171.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 72.8 p -84.26 170.47 13.67 Favored 'General case' 0 N--CA 1.426 -1.642 0 CA-C-O 120.98 0.419 . . . . 62.049999999999997 112.048 -173.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.587 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 35.9 pt -63.68 -24.85 36.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.689 -0.687 . . . . 70.25 110.255 174.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.86 -43.04 37.66 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.254 -0.647 . . . . 72.230000000000004 109.254 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . 0.535 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 7.9 t70 -69.64 -32.29 70.88 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.286 -0.87 . . . . 74.129999999999995 109.845 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.453 HG22 ' HA ' ' A' ' 458' ' ' ILE . 11.7 tt -74.53 -29.02 23.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 C-N-CA 120.293 -0.563 . . . . 73.209999999999994 110.288 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 85.6 mt -65.45 -36.06 82.76 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.564 -0.532 . . . . 70.400000000000006 109.564 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . 0.535 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 22.6 t70 -57.38 -56.23 24.48 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.371 -0.831 . . . . 63.210000000000001 109.074 171.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -53.3 -40.47 64.77 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 113.506 -1.679 . . . . 71.25 111.82 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 82.3 mt -73.26 -37.29 66.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.654 -0.703 . . . . 64.549999999999997 112.357 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.49 -137.16 39.62 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 119.762 -1.209 . . . . 72.540000000000006 112.09 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -57.43 -21.89 39.69 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 124.632 1.173 . . . . 73.430000000000007 112.354 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -69.39 -10.14 56.62 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.372 0.508 . . . . 71.219999999999999 112.372 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -65.98 -15.22 62.81 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.353 0.597 . . . . 73.230000000000004 110.933 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 13.9 m -87.54 -14.87 39.07 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-O 121.115 0.483 . . . . 64.209999999999994 111.014 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.2 6.69 20.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.64 0.978 . . . . 64.439999999999998 113.64 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 8.9 tt -90.58 151.47 3.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 N-CA-C 108.524 -0.917 . . . . 74.329999999999998 108.524 175.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -78.78 148.18 33.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.093 -0.706 . . . . 63.350000000000001 109.093 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 29.1 m -51.43 109.97 0.4 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.359 1.064 . . . . 64.340000000000003 112.777 -175.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 34.6 m170 64.13 28.68 14.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.509 1.124 . . . . 73.420000000000002 110.707 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.42 20.58 8.57 Favored Glycine 0 N--CA 1.43 -1.74 0 CA-C-N 114.986 -1.006 . . . . 42.200000000000003 113.453 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.83 106.15 17.57 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 N-CA-C 106.67 -1.604 . . . . 64.420000000000002 106.67 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -114.35 93.27 4.27 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 109.153 -0.684 . . . . 74.439999999999998 109.153 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . 0.402 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 1.5 pmm? -83.82 142.68 30.46 Favored 'General case' 0 C--N 1.294 -1.844 0 C-N-CA 120.564 -0.455 . . . . 64.329999999999998 109.935 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 57.3 t -76.74 124.92 35.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 106.581 -1.637 . . . . 74.099999999999994 106.581 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.23 154.95 18.55 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.16 0.505 . . . . 70.329999999999998 109.996 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -96.04 172.02 8.26 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 105.775 -1.935 . . . . 71.329999999999998 105.775 176.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -65.51 -5.18 7.22 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.693 0.997 . . . . 65.510000000000005 113.693 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . 0.472 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 36.2 tt0 -92.56 -1.11 57.17 Favored 'General case' 0 CA--C 1.555 1.17 0 CA-C-O 121.984 0.897 . . . . 70.230000000000004 109.25 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.19 30.65 62.56 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.629 -0.714 . . . . 65.140000000000001 112.83 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.472 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 93.9 mtt180 -127.81 148.6 67.7 Favored Pre-proline 0 C--N 1.306 -1.287 0 N-CA-C 107.905 -1.146 . . . . 71.439999999999998 107.905 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.92 133.45 54.82 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.08 2.52 . . . . 54.420000000000002 113.531 -177.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.9 m -73.73 -17.91 61.06 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 123.888 0.875 . . . . 73.099999999999994 111.165 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 118.02 -20.14 10.79 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 110.444 -1.062 . . . . 64.120000000000005 110.444 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -108.33 148.52 29.94 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 106.543 -1.651 . . . . 63.509999999999998 106.543 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.402 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -159.71 171.13 20.1 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 117.903 0.32 . . . . 55.039999999999999 110.803 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . 0.436 ' HA ' ' O ' ' A' ' 447' ' ' ILE . 98.3 m-85 -128.55 151.08 49.85 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.605 -0.725 . . . . 63.530000000000001 109.511 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 50.7 mt -131.14 137.41 55.78 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.737 0 N-CA-C 105.849 -1.908 . . . . 62.549999999999997 105.849 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -110.72 115.89 30.35 Favored 'General case' 0 C--N 1.276 -2.622 0 C-N-CA 119.197 -1.001 . . . . 74.239999999999995 109.223 177.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.405 ' CG ' ' HB3' ' A' ' 500' ' ' ARG . 3.2 tpt -92.73 167.09 12.11 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.718 -1.128 . . . . 64.340000000000003 108.996 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.411 ' HB3' ' HG2' ' A' ' 500' ' ' ARG . 39.7 ttmt -53.24 -45.45 68.75 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.95 1.3 . . . . 75.209999999999994 112.295 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 22.6 m -147.65 168.4 22.14 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.282 -0.872 . . . . 61.200000000000003 110.0 -173.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.47 93.86 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 123.863 0.727 . . . . 73.530000000000001 111.911 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -69.2 -37.69 78.22 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 108.912 -0.773 . . . . 73.430000000000007 108.912 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . 0.411 ' HG2' ' HB3' ' A' ' 496' ' ' LYS . 0.0 OUTLIER -58.69 -47.75 83.45 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.228 -1.351 . . . . 71.400000000000006 110.2 175.268 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -64.02 -39.06 93.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 65.109999999999999 110.495 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.75 -44.87 95.07 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.653 -0.703 . . . . 74.209999999999994 110.878 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 26.4 ttt -69.0 -37.23 78.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.146 -0.479 . . . . 73.230000000000004 110.18 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.99 83.17 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.81 -0.632 . . . . 65.409999999999997 110.515 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.85 -38.96 87.38 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.191 -0.458 . . . . 61.240000000000002 110.65 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -66.91 -41.4 87.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.12 0.486 . . . . 51.329999999999998 109.987 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -64.34 -40.26 95.53 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.578 -0.737 . . . . 72.239999999999995 111.36 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . 0.401 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 22.9 m -107.86 13.77 26.02 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 113.252 0.834 . . . . 71.230000000000004 113.252 -173.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -67.89 98.29 0.73 Allowed 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.884 -0.51 . . . . 73.219999999999999 109.714 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 85.8 tttt 66.09 54.5 0.98 Allowed 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.95 1.3 . . . . 72.430000000000007 109.604 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 54.2 tptt -93.26 140.35 29.63 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.701 -1.59 . . . . 60.119999999999997 109.023 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -84.7 113.7 21.49 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-O 121.077 0.465 . . . . 75.310000000000002 109.815 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 23.9 ttt -94.41 93.3 7.59 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 105.345 -2.094 . . . . 61.439999999999998 105.345 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 13.3 mptt 68.1 -82.26 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.871 -1.059 . . . . 72.049999999999997 111.333 -173.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -131.77 0.45 3.93 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 112.077 0.399 . . . . 71.420000000000002 112.077 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . 0.496 ' CZ ' ' HA ' ' A' ' 453' ' ' PRO . 15.8 ttm180 -118.49 146.54 44.44 Favored 'General case' 0 C--N 1.298 -1.671 0 C-N-CA 119.848 -0.741 . . . . 55.409999999999997 109.166 -176.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -89.59 120.76 31.17 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 109.111 -0.7 . . . . 74.329999999999998 109.111 -177.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 71.2 t -107.39 115.11 47.95 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.825 0 N-CA-C 107.246 -1.391 . . . . 73.409999999999997 107.246 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -94.19 112.75 24.59 Favored 'General case' 0 C--N 1.285 -2.21 0 N-CA-C 108.287 -1.005 . . . . 74.209999999999994 108.287 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -105.2 128.7 58.89 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.084 0 CA-C-N 115.439 -0.801 . . . . 63.420000000000002 110.373 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -128.83 159.55 35.39 Favored 'General case' 0 C--O 1.211 -0.924 0 C-N-CA 123.309 0.643 . . . . 71.049999999999997 109.302 -178.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . 0.446 HE21 ' N ' ' A' ' 523' ' ' CYS . 1.0 OUTLIER -93.22 143.92 25.79 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.401 -0.592 . . . . 62.32 109.401 178.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . 0.446 ' N ' HE21 ' A' ' 522' ' ' GLN . 7.3 p -141.6 171.1 14.52 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 122.872 0.469 . . . . 53.200000000000003 111.4 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.9 m -98.64 144.89 27.43 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 115.698 -0.683 . . . . 74.439999999999998 111.261 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . 0.408 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -62.84 -31.91 73.02 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.817 0.673 . . . . 75.439999999999998 112.817 -177.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.69 -41.12 92.79 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.943 0.402 . . . . 74.140000000000001 110.469 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 531' ' ' VAL . 35.8 tt0 -72.2 -39.03 68.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.394 0.616 . . . . 71.439999999999998 109.358 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -62.66 -44.04 97.28 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.1 -0.954 . . . . 73.430000000000007 109.71 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.48 -30.29 68.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.198 0.523 . . . . 64.519999999999996 110.411 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -65.71 -45.2 83.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.616 -0.72 . . . . 72.420000000000002 109.575 178.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 527' ' ' GLU . 58.3 t -67.02 -38.62 81.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.98 -0.555 . . . . 63.219999999999999 110.08 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 65.5 mt -67.15 -25.07 65.98 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.013 0.435 . . . . 75.299999999999997 111.487 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 27.1 ttt -87.32 -0.32 56.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.712 0.768 . . . . 71.340000000000003 110.691 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 65.39 37.83 94.27 Favored Glycine 0 C--N 1.305 -1.17 0 CA-C-N 114.975 -1.011 . . . . 55.329999999999998 111.425 -177.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -64.92 136.14 37.96 Favored Glycine 0 N--CA 1.413 -2.882 0 CA-C-N 115.196 -0.502 . . . . 63.210000000000001 113.525 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 25.6 m -96.61 131.12 43.58 Favored 'General case' 0 N--CA 1.418 -2.038 0 N-CA-C 108.211 -1.033 . . . . 65.219999999999999 108.211 177.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -120.69 125.56 47.98 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.617 -1.253 . . . . 43.43 107.617 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -126.89 92.79 3.61 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.242 0.544 . . . . 71.239999999999995 111.782 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -92.3 101.46 13.95 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 105.402 -2.073 . . . . 72.450000000000003 105.402 169.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.582 ' H ' HD23 ' A' ' 540' ' ' LEU . 1.9 pt? -103.37 136.52 42.97 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 114.67 1.359 . . . . 74.439999999999998 114.67 -167.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 . . . . . 0 N--CA 1.418 -2.07 0 N-CA-C 105.517 -2.031 . . . . 73.219999999999999 105.517 175.626 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.714 0 N-CA-C 108.49 -0.929 . . . . 74.310000000000002 108.49 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -65.27 117.99 5.06 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.205 1.937 . . . . 73.340000000000003 110.47 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -69.26 -40.06 6.63 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.397 2.065 . . . . 75.140000000000001 111.451 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 9.8 m -107.69 127.5 53.73 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.61 -0.885 . . . . 74.319999999999993 108.61 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . 0.45 ' HA ' ' HB3' ' A' ' 525' ' ' ALA . 53.8 m-80 -97.24 92.97 6.26 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.603 0.716 . . . . 63.340000000000003 111.771 -178.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . 0.474 ' HB ' ' OD2' ' A' ' 445' ' ' ASP . 25.5 t -116.9 166.35 11.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 N-CA-C 107.273 -1.38 . . . . 73.150000000000006 107.273 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.555 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 36.0 mtp85 -84.63 52.53 2.41 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 122.154 0.978 . . . . 73.420000000000002 109.731 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . 0.474 ' OD2' ' HB ' ' A' ' 443' ' ' VAL . 3.3 p30 -101.65 2.47 38.79 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.801 -1.091 . . . . 71.109999999999999 111.023 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 23.3 m -110.96 141.31 44.58 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 118.869 -1.132 . . . . 40.109999999999999 109.012 -174.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.4 mt -120.62 144.17 30.32 Favored 'Isoleucine or valine' 0 C--N 1.26 -3.318 0 N-CA-C 107.704 -1.221 . . . . 61.200000000000003 107.704 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . 0.549 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 28.0 ttp180 -119.67 124.97 47.57 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.333 0.587 . . . . 73.010000000000005 109.815 173.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 8.6 mt -93.75 133.54 37.02 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 105.907 -1.886 . . . . 75.329999999999998 105.907 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . 0.453 ' HD3' ' C ' ' A' ' 450' ' ' ARG . 2.0 tmt_? -128.17 130.96 48.87 Favored 'General case' 0 C--N 1.277 -2.586 0 CA-C-O 121.221 0.534 . . . . 74.010000000000005 109.667 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.438 ' O ' HG22 ' A' ' 518' ' ' VAL . . . 95.48 47.92 2.46 Favored Glycine 0 C--N 1.283 -2.365 0 N-CA-C 110.248 -1.141 . . . . 34.240000000000002 110.248 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 83.3 mt -72.63 148.69 90.34 Favored Pre-proline 0 C--N 1.312 -1.035 0 N-CA-C 111.763 0.282 . . . . 73.420000000000002 111.763 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.04 179.35 0.8 Allowed 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.701 2.267 . . . . 65.230000000000004 111.161 173.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -77.74 87.61 3.99 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 115.527 -0.761 . . . . 72.25 111.631 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 63.88 41.83 6.44 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 113.045 -1.889 . . . . 73.239999999999995 111.427 169.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -50.0 125.28 11.71 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 114.999 -1.0 . . . . 71.230000000000004 108.414 171.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 1.6 p -72.24 162.46 29.44 Favored 'General case' 0 N--CA 1.419 -1.99 0 N-CA-C 113.409 0.892 . . . . 73.120000000000005 113.409 -170.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.462 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.1 pt -60.25 -27.54 39.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 113.871 1.063 . . . . 73.25 113.871 -172.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.77 -26.68 34.25 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.129 -1.028 . . . . 65.510000000000005 110.38 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . 0.594 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 5.2 t70 -78.34 -28.48 47.24 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.019 -0.537 . . . . 75.140000000000001 110.462 -178.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.418 HG22 ' O ' ' A' ' 458' ' ' ILE . 15.4 tt -70.18 -32.04 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 C-N-CA 119.617 -0.833 . . . . 73.099999999999994 108.832 175.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 88.3 mt -70.71 -36.07 73.05 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.311 0.577 . . . . 72.319999999999993 109.507 176.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . 0.594 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 6.3 t70 -55.48 -55.96 25.8 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.746 -1.115 . . . . 72.230000000000004 108.825 173.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 113.749 -1.569 . . . . 75.150000000000006 111.598 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 57.9 mt -67.42 -29.96 69.59 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 113.062 0.764 . . . . 64.239999999999995 113.062 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.95 -137.92 26.15 Favored Glycine 0 N--CA 1.425 -2.066 0 C-N-CA 119.161 -1.495 . . . . 14.44 111.72 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -58.09 -28.12 64.3 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.699 -0.75 . . . . 63.219999999999999 112.372 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -70.67 -11.2 60.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.24 0.459 . . . . 72.25 112.24 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -64.44 -22.22 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.175 0.805 . . . . 34.439999999999998 113.175 -176.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 11.7 t -101.7 -3.15 28.71 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.618 0.723 . . . . 71.030000000000001 110.49 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.99 3.27 41.42 Favored 'General case' 0 C--O 1.245 0.841 0 CA-C-O 121.235 0.541 . . . . 72.5 111.319 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 10.4 tt -75.49 148.49 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.287 0 N-CA-C 107.627 -1.249 . . . . 75.230000000000004 107.627 173.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 62.2 mtm180 -79.38 164.85 23.7 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 120.113 -0.635 . . . . 75.409999999999997 110.967 176.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 8.8 m -52.87 107.12 0.2 Allowed 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.973 0.909 . . . . 71.230000000000004 112.128 -174.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 60.88 27.7 17.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.119 0.968 . . . . 64.140000000000001 111.629 177.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -72.85 -1.45 55.0 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.106 -0.952 . . . . 43.009999999999998 114.576 -176.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.8 p -86.42 115.26 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 CA-C-O 121.866 0.841 . . . . 64.409999999999997 109.622 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -124.64 96.77 5.02 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.851 -0.613 . . . . 61.030000000000001 109.85 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . 0.489 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 62.0 mtt -77.75 133.97 38.16 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.477 -0.934 . . . . 73.349999999999994 108.477 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 58.5 t -78.12 101.57 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.314 0 N-CA-C 107.551 -1.277 . . . . 61.420000000000002 107.551 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 73.8 mt -93.35 156.67 16.65 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-N 115.495 -0.775 . . . . 45.109999999999999 110.309 -177.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -103.31 179.76 4.18 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 105.878 -1.897 . . . . 73.239999999999995 105.878 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -55.57 -38.72 69.73 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 124.054 0.941 . . . . 54.509999999999998 112.424 -174.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.93 -1.85 27.52 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.274 0.559 . . . . 74.140000000000001 111.941 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 78.69 31.95 42.99 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.783 -0.722 . . . . 45.119999999999997 111.898 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -118.01 139.78 27.02 Favored Pre-proline 0 C--N 1.307 -1.264 0 N-CA-C 107.577 -1.268 . . . . 74.049999999999997 107.577 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.47 134.17 49.96 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.051 1.834 . . . . 73.299999999999997 110.987 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.8 m -75.94 1.87 14.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.647 0.737 . . . . 53.310000000000002 110.929 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.71 -30.76 6.23 Favored Glycine 0 CA--C 1.49 -1.481 0 CA-C-N 115.452 -0.794 . . . . 73.310000000000002 112.145 175.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . 0.479 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.1 p-10 -113.45 149.9 33.56 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-O 121.184 0.516 . . . . 55.119999999999997 111.639 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -150.75 155.56 39.52 Favored 'General case' 0 C--O 1.204 -1.31 0 CA-C-N 115.497 -0.774 . . . . 55.299999999999997 109.533 -177.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . 0.549 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 81.5 m-85 -111.28 146.09 37.62 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-O 121.189 0.519 . . . . 65.150000000000006 111.42 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 61.1 mt -126.51 122.13 60.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.899 0 N-CA-C 106.52 -1.659 . . . . 75.430000000000007 106.52 172.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -100.96 114.08 27.65 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 115.633 -0.712 . . . . 64.530000000000001 109.907 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 94.9 mmm -92.88 172.94 8.01 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.4 0.619 . . . . 64.140000000000001 111.419 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -75.51 -40.47 57.03 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.045 -0.979 . . . . 74.099999999999994 110.192 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 41.5 t -140.98 150.81 43.56 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 116.268 -0.423 . . . . 73.400000000000006 110.289 -175.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -65.56 -29.79 70.45 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 123.969 0.908 . . . . 73.409999999999997 112.324 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -64.08 -42.84 96.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.868 0.842 . . . . 74.019999999999996 109.693 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -68.53 -38.73 81.09 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 114.534 -1.212 . . . . 72.129999999999995 110.463 177.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.35 90.81 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.891 -0.595 . . . . 53.020000000000003 110.975 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -68.78 -42.26 77.67 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.848 -0.427 . . . . 74.140000000000001 109.848 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 51.1 ttm -64.26 -40.91 96.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.987 -0.551 . . . . 74.409999999999997 110.486 -177.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.37 -39.95 81.61 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 116.226 -0.443 . . . . 54.130000000000003 110.188 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.89 -37.22 81.5 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 116.17 -0.468 . . . . 65.010000000000005 111.123 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -65.32 -44.58 87.39 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.944 -0.391 . . . . 54.539999999999999 109.944 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -66.09 -39.95 90.4 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.87 -0.605 . . . . 72.329999999999998 110.583 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 38.2 m -99.43 12.38 36.53 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 113.259 0.837 . . . . 74.319999999999993 113.259 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -70.23 95.69 1.03 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.365 -0.834 . . . . 63.310000000000002 109.891 176.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.1 tttt 64.33 62.65 0.81 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.977 1.711 . . . . 75.409999999999997 110.056 -177.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -108.14 148.56 29.68 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 112.641 -2.072 . . . . 61.229999999999997 108.803 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -77.12 119.87 21.42 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.176 0.512 . . . . 62.450000000000003 110.221 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.6 ttt -103.98 80.32 1.73 Allowed 'General case' 0 N--CA 1.404 -2.729 0 N-CA-C 105.584 -2.006 . . . . 61.229999999999997 105.584 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . 0.501 ' HD2' ' N ' ' A' ' 514' ' ' LYS . 0.1 OUTLIER 68.8 -75.75 0.06 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 113.601 -1.636 . . . . 72.340000000000003 112.204 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -106.09 -31.79 8.55 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 113.292 0.849 . . . . 54.549999999999997 113.292 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -110.61 157.79 19.3 Favored 'General case' 0 C--N 1.273 -2.719 0 CA-C-N 115.788 -0.642 . . . . 74.310000000000002 110.542 -168.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -95.32 126.89 40.94 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.467 -1.679 . . . . 54.509999999999998 106.467 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 451' ' ' GLY . 66.7 t -114.06 120.28 63.42 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.678 0 N-CA-C 108.795 -0.817 . . . . 73.420000000000002 108.795 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.83 112.47 22.51 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 107.785 -1.191 . . . . 75.200000000000003 107.785 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 96.8 t -103.69 129.68 55.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 N-CA-C 109.963 -0.384 . . . . 53.32 109.963 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.662 -0.699 . . . . 74.200000000000003 109.244 -177.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . 0.465 ' HG2' ' N ' ' A' ' 523' ' ' CYS . 42.0 tt0 -87.63 155.64 19.85 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.038 -1.097 . . . . 63.350000000000001 108.038 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . 0.465 ' N ' ' HG2' ' A' ' 522' ' ' GLN . 7.9 p -162.05 171.69 17.12 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.461 0.648 . . . . 74.109999999999999 110.942 -178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 60.3 p -91.88 155.35 18.25 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.104 -0.953 . . . . 72.439999999999998 110.167 177.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 442' ' ' ASN . . . -55.67 -27.82 52.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.316 -0.856 . . . . 71.540000000000006 111.433 176.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.32 -51.87 67.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 55.240000000000002 109.168 176.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.7 -37.42 87.27 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.338 -0.846 . . . . 74.230000000000004 109.883 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . 0.456 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 24.8 ttt -61.56 -46.85 88.14 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.695 -0.684 . . . . 74.209999999999994 110.848 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -73.4 -28.97 62.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.925 -0.71 . . . . 73.319999999999993 109.639 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.33 -47.86 82.36 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 115.739 -0.664 . . . . 72.420000000000002 110.231 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.7 t -69.76 -34.54 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 120.826 -0.35 . . . . 75.140000000000001 110.276 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.3 mt -67.45 -30.78 70.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.903 0.382 . . . . 71.129999999999995 111.094 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 26.3 ttt -76.34 -12.13 60.02 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.131 0.967 . . . . 63.43 110.737 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 88.63 20.89 45.89 Favored Glycine 0 C--N 1.285 -2.288 0 CA-C-N 114.407 -1.27 . . . . 62.200000000000003 112.652 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . 77.35 -178.23 51.85 Favored Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 121.332 -0.461 . . . . 45.409999999999997 112.139 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 28.9 m -157.1 132.27 9.03 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.714 -1.217 . . . . 74.239999999999995 107.714 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 6.1 mp -93.53 89.12 6.15 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 107.477 -1.305 . . . . 60.119999999999997 107.477 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -101.62 82.36 2.28 Favored 'General case' 0 C--N 1.292 -1.932 0 CA-C-N 115.699 -0.682 . . . . 73.329999999999998 111.885 -173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -175.68 79.96 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.135 -0.939 . . . . 74.430000000000007 109.922 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.4 mp -111.42 81.34 1.43 Allowed 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.097 -1.446 . . . . 75.430000000000007 107.097 175.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 . . . . . 0 C--N 1.295 -1.791 0 N-CA-C 108.396 -0.964 . . . . 75.239999999999995 108.396 -175.357 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . 0.425 ' HA ' ' HD3' ' A' ' 439' ' ' PRO . 65.0 mtt . . . . . 0 CA--C 1.504 -0.808 0 N-CA-C 109.258 -0.645 . . . . 75.420000000000002 109.258 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 438' ' ' MET . 11.7 Cg_exo -72.19 120.98 7.14 Favored 'Trans proline' 0 C--O 1.247 0.954 0 C-N-CA 122.144 1.896 . . . . 75.040000000000006 110.542 176.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -58.28 107.64 0.34 Allowed 'Trans proline' 0 C--N 1.359 1.126 0 C-N-CA 122.037 1.825 . . . . 72.030000000000001 109.529 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 27.1 m -85.2 84.84 7.55 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-O 121.993 0.902 . . . . 60.32 111.889 -173.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -119.6 137.31 53.94 Favored 'General case' 0 C--N 1.291 -1.957 0 CA-C-N 114.796 -1.093 . . . . 60.039999999999999 108.45 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.44 140.52 19.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.421 0 O-C-N 124.292 0.995 . . . . 74.049999999999997 109.465 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.542 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 54.4 mtm180 -80.87 63.78 5.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.805 0.812 . . . . 74.340000000000003 109.758 176.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 40.7 p-10 -95.79 4.21 53.08 Favored 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 115.31 -0.859 . . . . 64.040000000000006 110.012 -175.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.597 ' SG ' ' HG3' ' A' ' 494' ' ' GLN . 39.3 m -102.7 149.43 24.45 Favored 'General case' 0 N--CA 1.411 -2.419 0 CA-C-O 121.616 0.722 . . . . 75.209999999999994 110.618 -174.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . 0.64 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.4 mt -125.46 145.4 32.89 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.738 0 CA-C-N 114.608 -1.178 . . . . 54.530000000000001 107.95 178.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -119.83 120.37 36.27 Favored 'General case' 0 N--CA 1.416 -2.161 0 N-CA-C 106.472 -1.677 . . . . 75.200000000000003 106.472 172.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 13.0 mt -103.93 131.5 51.1 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 106.741 -1.578 . . . . 75.239999999999995 106.741 -178.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -132.82 142.98 49.25 Favored 'General case' 0 C--N 1.257 -3.415 0 N-CA-C 108.497 -0.927 . . . . 71.120000000000005 108.497 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 96.4 26.24 11.27 Favored Glycine 0 C--N 1.289 -2.03 0 C-N-CA 120.052 -1.07 . . . . 63.340000000000003 110.765 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 64.3 mt -72.95 144.25 85.07 Favored Pre-proline 0 C--N 1.304 -1.376 0 N-CA-C 109.276 -0.638 . . . . 64.510000000000005 109.276 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -55.41 161.13 7.75 Favored 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.883 2.389 . . . . 70.510000000000005 112.001 175.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -77.35 90.63 3.79 Favored 'General case' 0 N--CA 1.411 -2.417 0 CA-C-N 115.067 -0.97 . . . . 72.040000000000006 111.04 -177.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 90.11 29.93 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 112.085 -2.325 . . . . 74.140000000000001 112.672 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.15 140.79 52.66 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.3 -1.37 . . . . 74.5 107.3 170.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 68.2 p -86.43 174.39 9.02 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 120.345 -0.542 . . . . 72.030000000000001 111.709 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.429 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 72.0 mt -63.97 -37.37 79.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 108.998 -0.742 . . . . 74.040000000000006 108.998 177.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.15 -37.6 87.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.86 -0.609 . . . . 73.209999999999994 109.811 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -65.75 -42.85 90.43 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.806 -0.634 . . . . 65.109999999999999 110.706 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . . . . . . . . . 9.3 tp -72.71 -33.39 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 119.98 -0.688 . . . . 71.200000000000003 110.681 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 92.6 mt -68.88 -32.86 72.83 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.156 0.503 . . . . 63.130000000000003 109.668 177.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.77 -52.71 59.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-N 115.127 -0.942 . . . . 51.549999999999997 108.766 176.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.26 -41.29 79.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.078 -1.419 . . . . 62.299999999999997 111.325 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 67.9 mt -67.78 -32.6 73.29 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.892 -0.594 . . . . 73.200000000000003 111.859 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 75.06 -124.09 7.61 Favored Glycine 0 N--CA 1.418 -2.537 0 C-N-CA 119.377 -1.392 . . . . 63.439999999999998 113.129 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -42.58 -42.21 3.31 Favored 'General case' 0 C--N 1.287 -2.146 0 C-N-CA 126.693 1.997 . . . . 72.530000000000001 112.625 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -66.16 -12.37 55.43 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.359 -0.837 . . . . 52.030000000000001 112.785 -172.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -74.35 -15.7 60.93 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.406 0.622 . . . . 60.310000000000002 110.352 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.5 m -85.23 -28.03 25.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.63 0.729 . . . . 53.229999999999997 110.238 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -106.75 15.68 25.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.906 0.86 . . . . 74.019999999999996 110.631 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 12.0 tt -68.43 142.6 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 N-CA-C 108.856 -0.794 . . . . 62.43 108.856 176.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.15 143.36 33.93 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 106.142 -1.799 . . . . 70.319999999999993 106.142 178.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 22.3 m -54.8 106.86 0.24 Allowed 'General case' 0 C--N 1.298 -1.635 0 O-C-N 124.254 0.971 . . . . 75.109999999999999 111.944 -172.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 27.0 m170 60.72 35.03 19.79 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.026 0.93 . . . . 73.400000000000006 111.729 -177.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -83.41 -0.39 90.02 Favored Glycine 0 N--CA 1.432 -1.625 0 CA-C-N 115.004 -0.998 . . . . 65.120000000000005 111.422 175.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 5.5 p -82.06 127.86 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 CA-C-O 121.221 0.534 . . . . 73.400000000000006 110.05 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -138.77 96.83 3.2 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.054 -1.091 . . . . 73.140000000000001 108.054 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . 0.507 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 55.4 ttm -78.24 139.75 38.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.366 -0.605 . . . . 74.5 109.366 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 74.7 t -94.29 110.61 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.726 0 CA-C-O 122.105 0.955 . . . . 73.209999999999994 111.136 -176.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.47 ' H ' HD23 ' A' ' 481' ' ' LEU . 0.7 OUTLIER -104.59 159.8 15.46 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.189 -1.368 . . . . 70.230000000000004 108.142 175.126 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -114.04 -168.97 1.43 Allowed 'General case' 0 C--N 1.273 -2.742 0 N-CA-C 108.435 -0.95 . . . . 72.349999999999994 108.435 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 31.9 t60 -54.14 -28.71 41.74 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 124.006 0.922 . . . . 61.310000000000002 111.97 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -75.01 -12.69 60.39 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.01 0.433 . . . . 73.420000000000002 110.888 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 79.76 25.18 58.83 Favored Glycine 0 N--CA 1.433 -1.554 0 N-CA-C 112.122 -0.391 . . . . 64.310000000000002 112.122 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -130.66 149.87 74.79 Favored Pre-proline 0 C--N 1.308 -1.207 0 N-CA-C 107.129 -1.434 . . . . 71.019999999999996 107.129 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . 0.507 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 12.3 Cg_endo -57.35 130.48 39.46 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.379 2.053 . . . . 73.409999999999997 111.576 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 16.3 m -81.35 9.07 7.73 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.299 -0.864 . . . . 74.519999999999996 111.033 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 80.6 23.33 60.45 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 109.871 -1.292 . . . . 61.450000000000003 109.871 -176.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -142.13 141.25 32.66 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.508 -1.293 . . . . 70.450000000000003 107.508 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.51 160.29 28.96 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 122.556 0.342 . . . . 53.509999999999998 110.31 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -118.97 144.41 46.5 Favored 'General case' 0 C--N 1.291 -1.974 0 N-CA-C 109.189 -0.671 . . . . 75.219999999999999 109.189 175.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.5 131.52 44.24 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 107.577 -1.268 . . . . 72.150000000000006 107.577 174.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.597 ' HG3' ' SG ' ' A' ' 446' ' ' CYS . 33.6 tt0 -104.98 131.94 51.87 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 108.165 -1.05 . . . . 70.510000000000005 108.165 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.64 ' SD ' HD11 ' A' ' 447' ' ' ILE . 67.9 mtp -104.43 178.07 4.67 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 123.008 0.523 . . . . 73.340000000000003 110.241 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -74.3 -36.05 63.72 Favored 'General case' 0 N--CA 1.407 -2.592 0 C-N-CA 123.329 0.652 . . . . 74.349999999999994 111.841 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 69.3 m -144.64 153.66 41.99 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 113.085 0.772 . . . . 63.109999999999999 113.085 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.05 68.77 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.523 1.129 . . . . 55.009999999999998 111.98 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.56 -49.3 77.93 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 115.783 -0.644 . . . . 72.209999999999994 111.62 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.85 -28.7 55.58 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.298 -0.561 . . . . 65.340000000000003 111.552 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.67 -43.57 96.31 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.512 0.507 . . . . 73.099999999999994 109.858 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -69.3 -38.86 78.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.314 0.578 . . . . 75.030000000000001 109.457 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.92 -44.01 97.78 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.285 -0.87 . . . . 42.43 109.622 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.8 97.97 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.877 -0.601 . . . . 35.0 110.6 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -71.58 -22.94 61.66 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 112.079 0.4 . . . . 64.209999999999994 112.079 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -85.72 -42.17 14.48 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.602 -0.518 . . . . 64.329999999999998 109.602 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -70.48 -38.47 74.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.84 -0.618 . . . . 70.040000000000006 109.997 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 56.6 m -107.84 23.8 13.91 Favored 'General case' 0 N--CA 1.421 -1.885 0 CA-C-N 115.831 -0.622 . . . . 62.420000000000002 110.92 -177.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . 0.449 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 29.3 t-80 -64.93 97.25 0.22 Allowed 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.606 -0.887 . . . . 71.209999999999994 108.606 172.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 97.9 mttt 59.32 62.55 1.77 Allowed 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.362 1.065 . . . . 71.319999999999993 110.341 -179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -103.71 134.04 47.69 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 114.919 -1.037 . . . . 71.430000000000007 109.049 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -73.32 133.33 43.83 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 116.013 -0.54 . . . . 61.109999999999999 110.919 -176.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.8 ttt -126.37 104.31 8.11 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 107.95 -1.13 . . . . 70.010000000000005 107.95 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.29 -72.66 0.1 Allowed 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 124.825 1.25 . . . . 75.450000000000003 110.782 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -141.16 -13.12 0.92 Allowed 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 112.754 0.65 . . . . 54.020000000000003 112.754 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . 0.409 ' HD3' ' N ' ' A' ' 517' ' ' TYR . 0.0 OUTLIER -124.92 149.72 47.3 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 108.246 -1.02 . . . . 73.109999999999999 108.246 -174.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . 0.409 ' N ' ' HD3' ' A' ' 516' ' ' ARG . 55.7 m-85 -88.25 128.56 35.47 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 112.714 0.635 . . . . 72.409999999999997 112.714 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 91.2 t -96.2 112.39 28.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.128 -1.396 . . . . 72.230000000000004 107.343 176.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -97.59 114.78 26.77 Favored 'General case' 0 C--N 1.269 -2.892 0 N-CA-C 106.973 -1.492 . . . . 74.510000000000005 106.973 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 78.4 t -104.08 123.71 58.02 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.883 -0.599 . . . . 73.310000000000002 109.884 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -121.63 147.92 45.23 Favored 'General case' 0 C--O 1.208 -1.116 0 C-N-CA 124.003 0.921 . . . . 73.340000000000003 108.842 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -95.66 152.43 18.46 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.226 0.466 . . . . 73.019999999999996 110.939 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 74.4 m -152.15 170.71 19.31 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 123.128 0.571 . . . . 73.510000000000005 110.592 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 35.1 t -105.38 156.78 17.85 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 116.212 -0.449 . . . . 63.140000000000001 109.976 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . 0.473 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -57.73 -42.89 84.77 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.217 0.451 . . . . 72.129999999999995 112.217 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.09 -31.49 70.26 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.68 0.753 . . . . 72.439999999999998 109.46 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -72.61 -37.26 68.15 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.999 -1.0 . . . . 51.420000000000002 110.678 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 42.8 ttm -61.44 -44.88 96.33 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.655 -0.868 . . . . 62.399999999999999 108.655 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . 0.407 ' O ' ' HG2' ' A' ' 533' ' ' MET . 8.6 t30 -62.41 -38.08 88.29 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.797 -1.092 . . . . 72.420000000000002 110.21 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -58.3 -47.89 82.24 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.691 0.796 . . . . 54.420000000000002 109.925 177.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.79 -34.42 56.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.174 0.511 . . . . 54.43 110.302 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 85.0 mt -71.21 -27.64 63.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.355 -0.384 . . . . 64.349999999999994 111.722 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 529' ' ' ASN . 24.6 mmt -81.17 7.28 11.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.169 0.509 . . . . 72.019999999999996 110.898 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 72.17 28.21 68.68 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.33 -0.85 . . . . 24.43 110.995 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . 95.24 157.78 32.49 Favored Glycine 0 N--CA 1.414 -2.789 0 N-CA-C 109.726 -1.35 . . . . 74.319999999999993 109.726 -176.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 21.2 m -136.9 120.43 17.11 Favored 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 108.984 -0.747 . . . . 54.240000000000002 108.984 178.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 84.8 mt -102.99 92.19 4.45 Favored 'General case' 0 C--N 1.281 -2.399 0 N-CA-C 107.733 -1.21 . . . . 70.019999999999996 107.733 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -96.15 159.23 15.06 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 116.068 -0.515 . . . . 51.020000000000003 109.657 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -106.06 164.4 12.01 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-N 115.781 -0.645 . . . . 74.030000000000001 109.515 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 6.8 mp -89.76 86.56 6.7 Favored 'General case' 0 C--N 1.289 -2.064 0 CA-C-O 121.376 0.608 . . . . 71.239999999999995 109.741 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 . . . . . 0 N--CA 1.425 -1.697 0 CA-C-N 114.882 -1.053 . . . . 72.140000000000001 109.475 178.013 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 CA--C 1.511 -0.55 0 N-CA-C 109.321 -0.622 . . . . 72.129999999999995 109.321 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -64.95 140.15 65.03 Favored 'Trans proline' 0 C--O 1.245 0.827 0 C-N-CA 122.19 1.927 . . . . 71.109999999999999 111.366 175.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -55.69 126.72 23.4 Favored 'Trans proline' 0 C--O 1.242 0.699 0 C-N-CA 122.746 2.298 . . . . 72.230000000000004 110.385 175.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.8 m 63.03 56.14 1.85 Allowed 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 122.544 1.164 . . . . 73.340000000000003 109.302 -176.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . 0.401 HD22 ' HB3' ' A' ' 525' ' ' ALA . 60.9 t30 -67.08 164.65 17.46 Favored 'General case' 0 C--O 1.25 1.108 0 CA-C-N 114.251 -1.34 . . . . 75.430000000000007 110.053 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 39.0 t -55.22 142.1 10.3 Favored 'Isoleucine or valine' 0 C--O 1.252 1.211 0 C-N-CA 124.177 0.991 . . . . 71.420000000000002 111.927 -174.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.567 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 98.6 mtt180 -89.5 70.26 7.96 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.099 -0.955 . . . . 74.030000000000001 109.991 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -123.22 18.7 9.9 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.256 -1.338 . . . . 72.140000000000001 110.497 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 63.6 m -113.43 156.82 22.81 Favored 'General case' 0 N--CA 1.417 -2.116 0 C-N-CA 119.682 -0.807 . . . . 75.5 109.424 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -129.18 139.11 52.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 N-CA-C 108.508 -0.923 . . . . 75.310000000000002 108.508 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 -108.2 120.93 43.77 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 107.045 -1.465 . . . . 73.109999999999999 107.045 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.486 HD22 HG22 ' A' ' 520' ' ' VAL . 12.3 mt -100.11 145.54 27.85 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.848 -1.538 . . . . 70.239999999999995 106.848 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -141.15 137.06 32.45 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 109.998 -0.371 . . . . 73.430000000000007 109.998 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 94.41 34.45 6.36 Favored Glycine 0 C--N 1.298 -1.548 0 CA-C-N 115.964 -0.562 . . . . 75.120000000000005 113.047 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 88.1 mt -75.3 150.31 85.03 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 116.881 0.341 . . . . 43.549999999999997 111.159 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.7 156.24 58.61 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 C-N-CA 122.868 2.379 . . . . 61.409999999999997 112.207 176.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -75.31 93.63 2.91 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 114.029 -1.442 . . . . 75.140000000000001 109.731 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 85.07 38.71 0.02 OUTLIER 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 111.841 -2.436 . . . . 75.140000000000001 111.388 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -58.24 137.49 57.04 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.205 -1.035 . . . . 74.200000000000003 108.205 169.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 15.4 p -81.5 156.93 25.03 Favored 'General case' 0 N--CA 1.416 -2.156 0 CA-C-N 116.66 -0.246 . . . . 65.209999999999994 110.535 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.464 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 63.3 mt -63.17 -32.52 56.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.746 0.784 . . . . 71.409999999999997 109.202 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -67.27 -36.14 80.97 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.486 -0.779 . . . . 71.209999999999994 110.216 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.08 -35.83 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.185 -0.462 . . . . 63.240000000000002 110.372 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.456 HG22 ' HA ' ' A' ' 458' ' ' ILE . 12.5 tt -73.35 -33.47 40.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 120.443 -0.503 . . . . 71.219999999999999 110.286 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.3 mt -67.71 -35.46 78.83 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.409 0.623 . . . . 72.319999999999993 109.526 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.28 -49.85 74.03 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-N 115.213 -0.903 . . . . 72.299999999999997 109.45 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -51.88 -44.97 63.95 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.025 -1.443 . . . . 74.200000000000003 111.002 177.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.9 -36.56 83.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.388 -0.823 . . . . 73.230000000000004 111.648 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 72.87 -132.17 16.9 Favored Glycine 0 CA--C 1.476 -2.367 0 C-N-CA 120.396 -0.907 . . . . 74.430000000000007 111.246 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -52.32 -36.37 53.11 Favored 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 124.973 1.309 . . . . 72.439999999999998 109.795 176.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -70.33 -5.8 30.57 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.101 -0.954 . . . . 73.219999999999999 112.756 -176.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -72.85 -15.51 61.61 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.421 0.629 . . . . 74.420000000000002 109.769 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 28.5 m -91.06 -16.91 27.1 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 121.748 0.785 . . . . 55.310000000000002 109.263 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . 0.475 ' O ' ' HG3' ' A' ' 495' ' ' MET . 69.2 m-20 -98.26 0.15 45.14 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.84 -0.618 . . . . 73.25 112.549 -174.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . 0.411 ' HA ' ' HA ' ' A' ' 495' ' ' MET . 14.2 tt -79.06 158.39 4.7 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 N-CA-C 108.378 -0.971 . . . . 74.239999999999995 108.378 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -87.93 157.57 18.91 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.785 -1.191 . . . . 73.329999999999998 107.785 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.2 m -52.19 107.13 0.18 Allowed 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 124.028 0.931 . . . . 74.129999999999995 112.298 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 49.3 m80 61.94 29.08 17.7 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.298 1.039 . . . . 70.439999999999998 111.408 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -78.06 -3.11 84.41 Favored Glycine 0 N--CA 1.439 -1.159 0 CA-C-N 115.63 -0.714 . . . . 73.030000000000001 112.774 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.449 ' HA ' HG13 ' A' ' 493' ' ' ILE . 5.0 p -83.07 103.24 10.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.17 0 CA-C-O 121.507 0.67 . . . . 74.310000000000002 110.686 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -114.99 91.75 3.72 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 116.246 -0.434 . . . . 72.239999999999995 110.116 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . 0.437 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 69.8 mtm -77.54 129.07 35.19 Favored 'General case' 0 CA--C 1.489 -1.392 0 N-CA-C 106.23 -1.767 . . . . 62.439999999999998 106.23 173.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 48.0 t -81.13 118.39 28.82 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-O 121.47 0.653 . . . . 72.0 110.523 -173.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 69.8 mt -96.59 152.84 18.25 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.451 -1.314 . . . . 72.040000000000006 107.451 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -92.59 -170.44 2.47 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 107.883 -1.154 . . . . 71.140000000000001 107.883 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -72.15 -5.2 33.84 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 124.022 0.929 . . . . 65.099999999999994 113.275 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -109.87 12.07 24.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-O 121.505 0.669 . . . . 53.439999999999998 109.525 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 68.05 31.78 75.69 Favored Glycine 0 CA--C 1.505 -0.558 0 CA-C-N 115.604 -0.725 . . . . 72.109999999999999 112.88 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -121.45 142.21 35.02 Favored Pre-proline 0 C--N 1.305 -1.342 0 N-CA-C 107.0 -1.482 . . . . 74.120000000000005 107.0 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -52.42 129.86 33.63 Favored 'Trans proline' 0 N--CA 1.477 0.53 0 C-N-CA 123.161 2.574 . . . . 72.420000000000002 113.373 -177.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.7 m -77.39 -20.76 54.2 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.859 -0.609 . . . . 53.539999999999999 110.118 178.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 114.58 -18.6 17.32 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.66 -0.7 . . . . 75.5 111.699 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -112.78 164.45 13.37 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 120.929 0.395 . . . . 52.149999999999999 110.244 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.437 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -155.17 160.28 40.78 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.628 -0.714 . . . . 53.539999999999999 109.083 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.52 120.27 25.09 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.518 -1.289 . . . . 74.329999999999998 107.518 174.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . 0.449 HG13 ' HA ' ' A' ' 477' ' ' VAL . 1.7 mp -111.9 132.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.256 0 N-CA-C 108.393 -0.966 . . . . 70.019999999999996 108.393 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -103.45 121.98 43.94 Favored 'General case' 0 C--N 1.258 -3.392 0 N-CA-C 108.022 -1.103 . . . . 71.329999999999998 108.022 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 471' ' ' ASP . 2.0 tpt -92.9 171.45 8.96 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.533 -0.758 . . . . 50.329999999999998 109.987 -173.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -74.57 -36.59 63.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.007 0.923 . . . . 75.200000000000003 109.941 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.2 m -146.51 152.11 38.46 Favored 'General case' 0 N--CA 1.423 -1.819 0 CA-C-N 115.799 -0.637 . . . . 34.409999999999997 109.797 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.62 -36.49 78.73 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.108 0.88 . . . . 72.200000000000003 111.765 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -61.08 -48.82 79.95 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 115.504 -0.771 . . . . 75.430000000000007 110.388 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -68.87 -31.08 69.77 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.556 -1.202 . . . . 74.0 112.294 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.27 -48.29 70.9 Favored 'General case' 0 C--N 1.309 -1.175 0 O-C-N 123.392 0.433 . . . . 73.150000000000006 110.041 175.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -66.88 -38.98 87.32 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 116.053 -0.522 . . . . 74.239999999999995 110.312 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 47.5 tpp -65.81 -41.28 92.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.99 -0.55 . . . . 65.349999999999994 110.532 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.08 77.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 120.902 0.382 . . . . 71.420000000000002 110.401 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.466 ' HA ' HG12 ' A' ' 520' ' ' VAL . . . -71.36 -36.98 71.66 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.864 -0.607 . . . . 73.409999999999997 111.799 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -46.29 68.1 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 107.588 -1.264 . . . . 73.299999999999997 107.588 177.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -62.86 -33.5 75.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.894 -1.048 . . . . 63.439999999999998 110.53 -177.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 61.9 m -116.05 19.66 14.86 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 114.83 1.419 . . . . 65.329999999999998 114.83 -176.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . 0.453 ' CD2' ' HD3' ' A' ' 510' ' ' LYS . 12.8 t60 -68.18 108.77 3.27 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 107.809 -1.182 . . . . 73.430000000000007 107.809 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.453 ' HD3' ' CD2' ' A' ' 509' ' ' HIS . 14.1 mptt 63.73 52.7 2.14 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 122.173 0.987 . . . . 53.210000000000001 110.45 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 21.9 tptm -89.11 139.63 30.27 Favored 'General case' 0 N--CA 1.412 -2.344 0 CA-C-N 114.539 -1.21 . . . . 74.25 109.194 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -76.9 121.93 24.12 Favored 'General case' 0 C--N 1.284 -2.248 0 N-CA-C 108.188 -1.042 . . . . 72.319999999999993 108.188 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -105.84 77.31 1.24 Allowed 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.428 -2.064 . . . . 63.539999999999999 105.428 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? 69.75 -81.94 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.812 -1.54 . . . . 65.510000000000005 110.022 -172.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -125.67 -4.88 7.05 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-O 122.135 0.969 . . . . 61.140000000000001 110.872 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -94.22 160.12 14.83 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.016 -1.476 . . . . 71.230000000000004 107.016 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -120.35 118.27 29.94 Favored 'General case' 0 C--N 1.285 -2.227 0 N-CA-C 106.722 -1.584 . . . . 70.230000000000004 106.722 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 96.0 t -112.79 134.6 54.88 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.996 0 CA-C-O 121.539 0.685 . . . . 72.129999999999995 111.458 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' A' ' 449' ' ' LEU . 32.0 tt0 -95.5 114.31 26.06 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.399 -0.963 . . . . 74.120000000000005 108.399 176.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . 0.486 HG22 HD22 ' A' ' 449' ' ' LEU . 57.3 t -109.39 112.84 42.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 N-CA-C 107.729 -1.211 . . . . 60.32 107.729 176.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -128.31 123.39 33.9 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.218 -0.301 . . . . 64.019999999999996 111.751 -174.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . 0.41 ' OE1' ' HB3' ' A' ' 444' ' ' ARG . 0.6 OUTLIER -70.99 136.0 48.16 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.883 0.373 . . . . 72.200000000000003 110.928 -178.784 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 61.4 m -145.01 170.37 16.29 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 124.39 1.076 . . . . 75.239999999999995 109.307 -177.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.567 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 40.4 t -82.88 154.15 24.76 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.32 -0.622 . . . . 74.299999999999997 109.32 175.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . 0.401 ' HB3' HD22 ' A' ' 442' ' ' ASN . . . -65.24 -23.57 67.1 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.433 -0.803 . . . . 63.109999999999999 109.489 175.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.98 -45.3 93.08 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.226 -0.657 . . . . 72.030000000000001 109.226 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -64.32 -40.63 96.29 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.075 0.464 . . . . 71.340000000000003 109.874 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . 0.483 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.9 ttt -60.07 -47.64 85.05 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.361 -0.836 . . . . 63.420000000000002 110.382 178.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.15 -37.92 84.61 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 115.322 -0.854 . . . . 60.509999999999998 110.072 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -63.02 -43.0 99.93 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.255 -0.884 . . . . 75.439999999999998 110.01 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.83 -37.15 72.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 120.776 -0.369 . . . . 71.549999999999997 110.442 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 528' ' ' MET . 90.1 mt -66.28 -26.06 67.16 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.913 0.387 . . . . 63.240000000000002 111.804 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 93.2 mmm -91.48 7.08 42.94 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.549 0.69 . . . . 64.019999999999996 111.266 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 69.73 22.65 76.88 Favored Glycine 0 C--N 1.311 -0.847 0 CA-C-N 115.409 -0.814 . . . . 71.25 112.869 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -65.52 132.3 35.19 Favored Glycine 0 N--CA 1.412 -2.929 0 O-C-N 123.592 0.231 . . . . 75.019999999999996 112.93 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.9 m -139.41 102.74 4.55 Favored 'General case' 0 N--CA 1.419 -2.001 0 N-CA-C 107.879 -1.156 . . . . 53.549999999999997 107.879 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 67.1 tp -110.34 127.73 55.2 Favored 'General case' 0 C--N 1.285 -2.214 0 CA-C-N 115.76 -0.655 . . . . 63.43 110.19 -176.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -140.35 151.58 45.12 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.406 -0.961 . . . . 72.129999999999995 108.406 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -128.28 104.23 7.62 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.583 -0.525 . . . . 73.310000000000002 109.583 176.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.9 tt -91.29 99.2 12.22 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 106.529 -1.656 . . . . 61.25 106.529 178.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 . . . . . 0 C--N 1.295 -1.8 0 N-CA-C 108.342 -0.985 . . . . 65.400000000000006 108.342 -178.923 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 59.0 mtt . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 108.308 -0.997 . . . . 62.32 108.308 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -62.55 121.76 9.85 Favored 'Trans proline' 0 C--O 1.246 0.897 0 C-N-CA 122.752 2.301 . . . . 63.240000000000002 112.795 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -79.03 83.07 2.34 Favored 'Trans proline' 0 N--CA 1.441 -1.574 0 C-N-CA 122.098 1.866 . . . . 63.020000000000003 108.532 172.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 2.0 p -69.73 97.96 1.14 Allowed 'General case' 0 N--CA 1.423 -1.808 0 CA-C-N 115.122 -0.944 . . . . 74.530000000000001 112.048 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . 0.574 ' OD1' ' HB2' ' A' ' 524' ' ' SER . 0.1 OUTLIER -143.59 164.54 30.1 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.087 -0.961 . . . . 75.239999999999995 109.086 179.721 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 22.1 t -108.76 151.51 11.02 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.245 0 N-CA-C 107.199 -1.408 . . . . 63.240000000000002 107.199 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.599 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 95.5 mtt180 -94.01 75.42 4.13 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 122.313 1.054 . . . . 73.329999999999998 108.32 174.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.1 p30 -122.3 10.62 9.95 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 113.39 -1.732 . . . . 74.120000000000005 111.456 -172.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 525' ' ' ALA . 29.3 m -104.61 141.36 36.57 Favored 'General case' 0 N--CA 1.4 -2.947 0 N-CA-C 108.417 -0.957 . . . . 62.43 108.417 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -123.73 139.11 51.24 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.415 0 N-CA-C 107.766 -1.198 . . . . 60.149999999999999 107.766 -177.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . 0.467 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.4 ttp180 -114.38 123.95 50.74 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 108.948 -0.76 . . . . 71.439999999999998 108.948 175.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.441 ' CD1' HD11 ' A' ' 461' ' ' ILE . 5.6 mt -102.11 138.1 39.5 Favored 'General case' 0 C--N 1.285 -2.235 0 N-CA-C 106.387 -1.709 . . . . 73.219999999999999 106.387 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 63.0 ttp180 -132.38 125.06 29.94 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-O 121.168 0.508 . . . . 62.210000000000001 110.15 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.42 45.69 1.41 Allowed Glycine 0 C--N 1.272 -2.985 0 CA-C-N 115.1 -0.954 . . . . 75.25 111.111 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 92.9 mt -84.19 140.26 39.49 Favored Pre-proline 0 N--CA 1.433 -1.309 0 O-C-N 122.86 -0.2 . . . . 74.040000000000006 110.547 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.55 150.75 33.71 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 123.208 2.606 . . . . 73.349999999999994 112.713 176.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -72.97 103.4 3.75 Favored 'General case' 0 N--CA 1.396 -3.169 0 N-CA-C 107.304 -1.369 . . . . 72.200000000000003 107.304 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 91.94 33.37 0.01 OUTLIER 'General case' 0 C--N 1.279 -2.469 0 CA-C-N 111.254 -2.703 . . . . 65.450000000000003 112.446 175.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -71.44 109.17 5.25 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 107.17 -1.419 . . . . 73.200000000000003 107.17 168.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.7 p -75.23 167.79 21.24 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.71 0.291 . . . . 72.329999999999998 110.791 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 59.7 mt -63.85 -32.49 57.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.983 0.421 . . . . 74.439999999999998 110.392 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.84 -49.75 69.36 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.306 0.574 . . . . 73.219999999999999 109.563 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' A' ' 463' ' ' ASP . 34.1 t70 -67.32 -32.14 72.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.277 -0.874 . . . . 75.319999999999993 111.324 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.517 HG22 ' HA ' ' A' ' 458' ' ' ILE . 11.2 tt -75.94 -30.37 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 109.959 -0.385 . . . . 75.209999999999994 109.959 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 90.6 mt -68.53 -35.03 76.9 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.25 -0.648 . . . . 73.439999999999998 109.25 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 460' ' ' ASP . 24.0 t70 -60.04 -51.68 68.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.21 -0.905 . . . . 72.219999999999999 109.242 173.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -55.16 -40.21 70.39 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.204 -1.362 . . . . 64.209999999999994 111.912 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.54 -31.96 73.3 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.982 -0.554 . . . . 75.319999999999993 111.911 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.83 -128.94 15.36 Favored Glycine 0 CA--C 1.474 -2.491 0 C-N-CA 120.447 -0.882 . . . . 54.539999999999999 111.922 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -58.93 -28.37 66.18 Favored 'General case' 0 C--N 1.273 -2.735 0 CA-C-N 113.802 -1.199 . . . . 72.120000000000005 111.698 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -75.74 -5.88 47.88 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 112.454 0.539 . . . . 65.439999999999998 112.454 -178.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.54 63.56 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.309 0.576 . . . . 53.329999999999998 111.422 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 16.4 m -97.85 -6.32 32.77 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 121.371 0.605 . . . . 64.120000000000005 109.971 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . 0.457 ' CG ' ' HD3' ' A' ' 500' ' ' ARG . 70.6 m-20 -99.22 -5.73 29.4 Favored 'General case' 0 C--O 1.242 0.69 0 O-C-N 121.94 -0.475 . . . . 44.43 112.2 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . 0.462 ' HA ' ' SD ' ' A' ' 495' ' ' MET . 13.0 tt -69.02 148.48 11.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 CA-C-N 115.273 -0.876 . . . . 71.530000000000001 109.897 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -72.28 173.39 8.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.132 -0.627 . . . . 62.109999999999999 110.499 176.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 26.9 m -62.05 102.83 0.31 Allowed 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.302 -0.863 . . . . 73.319999999999993 108.973 176.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 58.05 52.8 7.31 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.939 1.295 . . . . 74.0 108.281 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -73.72 -16.42 79.2 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.904 -1.044 . . . . 74.439999999999998 113.439 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.51 121.39 36.66 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-O 121.701 0.762 . . . . 74.319999999999993 111.45 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -132.95 106.84 7.92 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 107.515 -1.291 . . . . 73.349999999999994 107.515 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.9 mtt -88.12 139.57 30.37 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 120.214 -0.595 . . . . 74.430000000000007 110.306 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 61.8 t -83.54 107.19 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.481 -0.933 . . . . 62.409999999999997 108.481 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 71.7 mt -88.65 154.67 20.12 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 114.436 -1.256 . . . . 75.430000000000007 109.748 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -92.81 160.84 14.76 Favored 'General case' 0 C--N 1.284 -2.261 0 N-CA-C 104.72 -2.326 . . . . 73.420000000000002 104.72 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -64.51 -14.17 56.02 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 119.2 0.909 . . . . 75.540000000000006 112.031 -178.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . 0.404 ' OE1' ' HG3' ' A' ' 486' ' ' ARG . 34.9 tt0 -71.31 -16.72 62.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.414 0.685 . . . . 73.409999999999997 109.99 173.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.52 33.44 22.3 Favored Glycine 0 N--CA 1.435 -1.397 0 CA-C-O 121.941 0.745 . . . . 61.219999999999999 111.285 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.404 ' HG3' ' OE1' ' A' ' 484' ' ' GLN . 4.9 mmp_? -128.61 150.83 75.77 Favored Pre-proline 0 C--N 1.29 -1.98 0 N-CA-C 106.127 -1.805 . . . . 63.530000000000001 106.127 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.39 126.58 18.78 Favored 'Trans proline' 0 C--O 1.247 0.968 0 C-N-CA 121.587 1.524 . . . . 71.140000000000001 111.39 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 20.0 m -67.92 -24.86 65.24 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.605 0.716 . . . . 63.130000000000003 110.198 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 125.86 -20.15 6.44 Favored Glycine 0 N--CA 1.429 -1.784 0 N-CA-C 110.91 -0.876 . . . . 52.420000000000002 110.91 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -111.14 154.44 24.32 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.881 0.372 . . . . 61.109999999999999 110.752 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.59 40.81 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.286 -0.635 . . . . 63.350000000000001 109.286 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . 0.467 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 85.4 m-85 -118.36 137.48 53.08 Favored 'General case' 0 C--N 1.293 -1.871 0 N-CA-C 109.315 -0.624 . . . . 74.209999999999994 109.315 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 52.5 mt -125.3 124.95 68.27 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.202 0 N-CA-C 107.22 -1.4 . . . . 64.310000000000002 107.22 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -102.86 122.93 45.53 Favored 'General case' 0 C--N 1.27 -2.885 0 CA-C-N 115.683 -0.69 . . . . 71.140000000000001 110.247 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 472' ' ' ILE . 26.2 mmt -96.45 169.29 10.01 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 123.691 0.796 . . . . 75.420000000000002 111.608 -176.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -65.32 -32.47 74.14 Favored 'General case' 0 N--CA 1.421 -1.919 0 CA-C-N 115.492 -0.777 . . . . 64.319999999999993 112.737 178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 38.8 p -152.5 163.94 38.57 Favored 'General case' 0 C--O 1.25 1.106 0 CA-C-O 120.587 0.232 . . . . 72.150000000000006 111.389 -177.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.24 85.14 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 123.723 0.809 . . . . 63.409999999999997 111.443 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -54.45 -50.57 67.37 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.406 -0.816 . . . . 73.109999999999999 111.832 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . 0.457 ' HD3' ' CG ' ' A' ' 471' ' ' ASP . 2.4 mmp_? -64.53 -42.2 95.91 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 113.846 -1.524 . . . . 75.140000000000001 109.77 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.8 -42.04 91.17 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.038 -0.983 . . . . 70.040000000000006 110.683 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -64.57 -41.62 96.17 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.816 -0.629 . . . . 54.32 110.893 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.0 mtp -74.09 -34.61 64.03 Favored 'General case' 0 CA--C 1.508 -0.64 0 C-N-CA 119.625 -0.83 . . . . 63.43 110.85 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -68.87 -40.4 79.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 116.25 -0.432 . . . . 71.329999999999998 110.09 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -67.7 -38.72 84.04 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 116.112 -0.494 . . . . 73.549999999999997 111.195 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -67.8 -42.38 81.66 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.497 -0.32 . . . . 74.109999999999999 110.927 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.4 -41.8 75.96 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 120.595 -0.442 . . . . 75.329999999999998 110.819 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 47.9 m -95.93 11.39 34.05 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 113.241 0.83 . . . . 65.310000000000002 113.241 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -66.17 97.6 0.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 O-C-N 121.324 -0.86 . . . . 74.420000000000002 110.861 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.496 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 21.6 ttmm 75.22 33.12 0.72 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.301 1.44 . . . . 71.219999999999999 109.484 175.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -80.59 150.4 29.53 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.462 -1.245 . . . . 73.140000000000001 109.817 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.15 143.56 33.77 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 120.69 0.281 . . . . 75.349999999999994 110.528 177.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.4 ttt -140.37 103.67 4.62 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.927 -1.138 . . . . 74.409999999999997 107.927 175.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp 66.81 -84.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 125.008 1.323 . . . . 63.420000000000002 111.013 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.31 -0.52 2.98 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.919 -0.771 . . . . 65.049999999999997 108.919 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -113.7 160.48 18.59 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.127 -1.064 . . . . 74.120000000000005 108.127 -172.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -113.45 118.85 35.65 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.659 -0.867 . . . . 70.120000000000005 108.659 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.85 112.66 35.73 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 CA-C-O 121.537 0.684 . . . . 64.120000000000005 109.558 -176.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . 0.496 ' HA ' ' H ' ' A' ' 510' ' ' LYS . 42.0 mt-10 -94.49 112.32 24.09 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 107.724 -1.213 . . . . 74.120000000000005 107.724 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.7 t -104.53 127.91 58.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 CA-C-O 121.111 0.481 . . . . 71.409999999999997 111.938 -176.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.78 148.36 48.18 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.502 -0.772 . . . . 72.209999999999994 109.365 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.55 142.06 32.54 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 122.41 0.284 . . . . 65.219999999999999 110.453 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.7 p -147.61 173.68 12.48 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.456 0.646 . . . . 74.25 111.839 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 80.3 p -85.02 158.99 20.31 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.217 -0.901 . . . . 74.400000000000006 110.584 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . 0.552 ' HA ' ' SG ' ' A' ' 446' ' ' CYS . . . -64.67 -29.04 70.04 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.968 -0.56 . . . . 65.319999999999993 110.038 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -73.93 -35.77 64.62 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 116.047 -0.524 . . . . 74.420000000000002 110.313 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -64.42 -47.14 80.27 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.379 -0.971 . . . . 73.120000000000005 108.379 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 23.5 ttt -60.45 -42.98 97.27 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.511 -1.222 . . . . 62.130000000000003 109.969 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -60.72 -45.51 93.99 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.017 -0.992 . . . . 74.430000000000007 109.63 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.59 -40.86 98.03 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.865 0.364 . . . . 74.099999999999994 111.076 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.25 -39.8 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.339 0.59 . . . . 71.040000000000006 110.751 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt -81.9 -19.75 40.21 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.649 0.611 . . . . 72.450000000000003 112.649 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 25.9 ttt -85.31 5.67 29.57 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.996 0.903 . . . . 75.219999999999999 110.505 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 75.94 35.71 43.87 Favored Glycine 0 N--CA 1.434 -1.447 0 CA-C-N 114.901 -1.045 . . . . 52.140000000000001 112.494 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -70.34 146.78 43.04 Favored Glycine 0 N--CA 1.41 -3.047 0 N-CA-C 111.806 -0.518 . . . . 71.420000000000002 111.806 178.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 8.4 t -71.51 137.66 48.31 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.119 0.485 . . . . 70.239999999999995 109.791 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.78 80.47 1.77 Allowed 'General case' 0 N--CA 1.425 -1.687 0 CA-C-O 121.931 0.872 . . . . 73.310000000000002 109.22 -177.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -148.28 156.03 42.05 Favored 'General case' 0 C--N 1.288 -2.091 0 N-CA-C 107.198 -1.408 . . . . 73.319999999999993 107.198 175.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -131.08 116.59 17.95 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-O 121.12 0.486 . . . . 62.229999999999997 110.916 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 83.0 mt -120.7 81.72 1.81 Allowed 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 105.972 -1.862 . . . . 63.020000000000003 105.972 172.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 . . . . . 0 N--CA 1.467 0.388 0 C-N-CA 124.394 1.077 . . . . 53.530000000000001 110.584 -174.387 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 72.4 mtm . . . . . 0 C--O 1.238 0.477 0 N-CA-C 109.604 -0.517 . . . . 52.439999999999998 109.604 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -85.06 164.76 11.46 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.284 1.989 . . . . 61.25 111.374 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -58.59 119.86 7.38 Favored 'Trans proline' 0 C--O 1.247 0.945 0 C-N-CA 122.131 1.887 . . . . 71.140000000000001 108.461 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 6.3 t -111.95 114.14 26.87 Favored 'General case' 0 N--CA 1.412 -2.335 0 CA-C-O 122.229 1.014 . . . . 70.540000000000006 113.316 -170.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -87.82 95.57 10.14 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 104.312 -2.477 . . . . 15.210000000000001 104.312 168.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.95 153.57 6.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.729 0 CA-C-N 115.419 -0.81 . . . . 73.230000000000004 110.584 -171.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.579 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 69.0 ttt180 -83.88 68.23 9.89 Favored 'General case' 0 N--CA 1.41 -2.459 0 N-CA-C 108.806 -0.813 . . . . 74.239999999999995 108.806 174.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -119.66 16.38 12.79 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.229 1.012 . . . . 71.109999999999999 111.064 -178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 39.4 m -112.25 162.52 15.4 Favored 'General case' 0 N--CA 1.414 -2.257 0 N-CA-C 108.376 -0.972 . . . . 74.310000000000002 108.376 -176.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.3 mt -128.18 138.42 54.73 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 N-CA-C 107.254 -1.387 . . . . 64.510000000000005 107.254 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -111.16 120.16 41.37 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 107.291 -1.374 . . . . 73.420000000000002 107.291 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.552 HD22 HG22 ' A' ' 520' ' ' VAL . 11.1 mt -97.56 139.16 33.88 Favored 'General case' 0 C--N 1.283 -2.314 0 N-CA-C 106.325 -1.731 . . . . 64.340000000000003 106.325 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -138.1 132.32 31.86 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 109.226 -0.657 . . . . 72.230000000000004 109.226 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 102.83 38.56 2.91 Favored Glycine 0 C--N 1.289 -2.073 0 N-CA-C 110.441 -1.064 . . . . 64.040000000000006 110.441 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.82 138.03 96.34 Favored Pre-proline 0 C--O 1.243 0.75 0 CA-C-N 115.434 -0.383 . . . . 70.209999999999994 111.761 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.11 171.93 6.92 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.339 2.693 . . . . 63.229999999999997 113.41 176.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -77.65 99.51 5.82 Favored 'General case' 0 N--CA 1.394 -3.25 0 CA-C-N 113.44 -1.709 . . . . 74.010000000000005 108.959 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 79.57 33.42 0.21 Allowed 'General case' 0 C--N 1.272 -2.778 0 CA-C-N 112.157 -2.292 . . . . 74.310000000000002 112.005 170.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -62.38 113.31 2.85 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.149 -1.056 . . . . 65.299999999999997 108.149 171.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 41.6 p -80.12 170.09 16.92 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 116.361 -0.381 . . . . 74.239999999999995 111.336 -175.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 36.5 pt -61.43 -34.45 61.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 N-CA-C 112.225 0.454 . . . . 73.099999999999994 112.225 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.12 -33.77 63.69 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 119.625 -0.83 . . . . 73.129999999999995 110.66 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.27 -37.71 74.94 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.038 0.447 . . . . 53.520000000000003 110.511 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.472 HG22 ' HA ' ' A' ' 458' ' ' ILE . 14.0 tt -70.65 -37.57 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 116.251 -0.431 . . . . 65.329999999999998 110.22 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 94.5 mt -67.62 -35.24 78.56 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.151 0.5 . . . . 74.099999999999994 110.121 177.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -62.95 -47.79 81.68 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.716 -0.675 . . . . 74.319999999999993 109.25 177.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -56.67 -42.87 79.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.562 -1.199 . . . . 71.420000000000002 110.938 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.77 -29.26 70.49 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.71 -0.677 . . . . 73.140000000000001 111.415 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 64.65 -121.13 21.41 Favored Glycine 0 CA--C 1.475 -2.468 0 CA-C-O 122.044 0.802 . . . . 63.43 113.088 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -51.75 -41.07 61.31 Favored 'General case' 0 C--N 1.266 -3.058 0 CA-C-N 112.675 -1.762 . . . . 61.420000000000002 111.405 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -82.36 1.87 35.09 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.608 -0.723 . . . . 64.519999999999996 112.52 -172.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -75.54 -15.67 60.35 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-O 121.078 0.466 . . . . 74.25 111.215 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 22.8 m -92.04 -14.47 29.29 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.342 0.592 . . . . 73.209999999999994 110.327 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . 0.455 ' CB ' ' HG2' ' A' ' 500' ' ' ARG . 2.9 m-20 -100.27 3.21 43.35 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 116.102 -0.499 . . . . 73.340000000000003 112.295 -176.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 473' ' ' ARG . 10.6 tt -73.31 148.79 8.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 N-CA-C 108.26 -1.015 . . . . 63.329999999999998 108.26 176.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . 0.409 ' O ' HG12 ' A' ' 472' ' ' ILE . 71.8 mtp180 -79.21 156.99 27.92 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.95 -1.13 . . . . 71.299999999999997 107.95 174.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 2.0 p -61.15 110.82 1.49 Allowed 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 112.487 0.551 . . . . 71.329999999999998 112.487 -178.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 63.21 35.26 12.78 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.664 1.186 . . . . 61.43 108.899 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.85 -10.52 83.62 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 114.854 -1.066 . . . . 71.299999999999997 111.202 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.2 p -81.21 105.07 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-O 122.162 0.982 . . . . 55.299999999999997 110.654 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -113.11 98.85 7.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.05 -0.977 . . . . 74.209999999999994 109.809 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 67.8 mtm -82.15 130.99 35.23 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.995 -1.113 . . . . 55.219999999999999 107.995 177.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . 0.518 ' O ' ' HA ' ' A' ' 487' ' ' PRO . 52.3 t -82.98 122.14 36.99 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 107.378 -1.342 . . . . 64.219999999999999 107.378 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.9 mt -99.99 154.9 18.02 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.226 0.536 . . . . 54.030000000000001 110.948 -175.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -102.72 175.66 5.42 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 105.417 -2.068 . . . . 64.25 105.417 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -60.0 -24.91 64.84 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.389 0.541 . . . . 72.349999999999994 110.713 -178.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . 0.48 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 8.6 tt0 -68.29 -17.24 64.23 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 123.684 0.794 . . . . 73.310000000000002 111.095 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.24 28.9 35.18 Favored Glycine 0 N--CA 1.441 -1.002 0 CA-C-N 116.151 -0.477 . . . . 65.030000000000001 112.168 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.48 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 96.3 mtt180 -131.98 153.63 81.44 Favored Pre-proline 0 C--N 1.302 -1.474 0 N-CA-C 107.734 -1.21 . . . . 73.239999999999995 107.734 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . 0.518 ' HA ' ' O ' ' A' ' 480' ' ' VAL . 11.5 Cg_endo -56.32 133.25 56.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.514 2.143 . . . . 64.420000000000002 111.509 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 22.5 m -64.87 -12.57 50.21 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 123.751 0.82 . . . . 73.420000000000002 111.334 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 123.73 -12.72 8.24 Favored Glycine 0 CA--C 1.48 -2.108 0 N-CA-C 110.685 -0.966 . . . . 71.230000000000004 110.685 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . 0.412 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 9.6 p-10 -124.74 156.21 38.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-O 121.104 0.478 . . . . 72.239999999999995 110.601 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.5 150.79 29.97 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.195 -0.911 . . . . 70.109999999999999 108.751 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -112.04 127.87 56.02 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 108.906 -0.776 . . . . 75.140000000000001 108.906 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.54 128.75 73.8 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 107.921 -1.14 . . . . 73.409999999999997 107.921 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -104.29 124.36 49.03 Favored 'General case' 0 C--N 1.276 -2.589 0 CA-C-N 115.99 -0.55 . . . . 74.319999999999993 110.834 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -93.88 170.65 9.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.495 -0.775 . . . . 74.010000000000005 111.171 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -69.48 -28.54 66.16 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.87 -1.059 . . . . 73.019999999999996 110.097 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 25.5 m -154.42 151.16 28.66 Favored 'General case' 0 C--O 1.253 1.261 0 N-CA-C 109.332 -0.618 . . . . 74.310000000000002 109.332 -175.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -62.42 -25.71 68.1 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.119 0.968 . . . . 65.5 112.847 -177.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . 0.432 ' HB2' ' HD2' ' A' ' 500' ' ' ARG . 3.3 m-20 -54.69 -51.65 64.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.811 0.815 . . . . 74.530000000000001 110.083 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . 0.455 ' HG2' ' CB ' ' A' ' 471' ' ' ASP . 10.1 mpt_? -65.88 -38.0 87.64 Favored 'General case' 0 CA--C 1.496 -1.127 0 CA-C-N 114.426 -1.261 . . . . 74.230000000000004 110.381 -176.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.44 88.91 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.45 -0.795 . . . . 54.219999999999999 110.84 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . 0.412 ' HA ' ' HG3' ' A' ' 522' ' ' GLN . 66.2 t80 -68.66 -40.87 80.0 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.23 0.538 . . . . 61.420000000000002 110.177 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 66.6 mtt -70.31 -38.08 74.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.78 -0.646 . . . . 74.030000000000001 110.79 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.47 -41.98 83.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.305 -0.407 . . . . 64.209999999999994 110.37 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.46 ' HA ' HG12 ' A' ' 520' ' ' VAL . . . -67.41 -38.15 84.17 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 116.365 -0.38 . . . . 71.140000000000001 110.827 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -70.39 -39.51 74.47 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.747 -0.381 . . . . 73.209999999999994 111.1 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.57 -28.49 56.26 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.014 0.435 . . . . 74.420000000000002 111.128 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 39.7 m -114.99 18.56 16.31 Favored 'General case' 0 C--O 1.254 1.294 0 N-CA-C 113.13 0.789 . . . . 73.049999999999997 113.13 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -68.51 106.6 2.61 Favored 'General case' 0 C--O 1.243 0.715 0 O-C-N 121.052 -1.03 . . . . 73.219999999999999 109.868 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 81.3 tttt 72.53 29.8 2.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.833 1.253 . . . . 61.229999999999997 109.831 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.08 146.81 35.01 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.725 -1.125 . . . . 72.120000000000005 109.123 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 517' ' ' TYR . 9.0 p30 -87.28 137.28 32.47 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 120.525 -0.47 . . . . 43.5 111.171 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.5 ttt -125.42 91.65 3.46 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.511 -1.292 . . . . 74.040000000000006 107.511 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.6 -86.75 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.764 -1.107 . . . . 74.209999999999994 112.505 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.37 -27.16 13.61 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 113.424 0.898 . . . . 63.530000000000001 113.424 -172.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -130.6 157.84 41.63 Favored 'General case' 0 C--N 1.274 -2.69 0 CA-C-N 115.854 -0.612 . . . . 72.239999999999995 110.836 -167.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 512' ' ' ASN . 97.6 m-85 -95.56 125.85 40.44 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.152 -0.684 . . . . 75.510000000000005 109.152 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 66.7 t -106.92 117.24 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.543 0 CA-C-N 114.994 -1.003 . . . . 74.329999999999998 109.764 -175.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -81.7 110.6 17.19 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 107.125 -1.435 . . . . 52.140000000000001 107.125 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . 0.552 HG22 HD22 ' A' ' 449' ' ' LEU . 75.4 t -103.57 107.65 22.7 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 107.388 -1.338 . . . . 71.239999999999995 107.388 177.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -116.43 144.25 44.54 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.965 -0.754 . . . . 63.200000000000003 108.965 -175.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . 0.412 ' HG3' ' HA ' ' A' ' 502' ' ' PHE . 0.2 OUTLIER -89.04 123.8 33.68 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.769 -1.197 . . . . 55.100000000000001 107.769 -175.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 88.7 m -132.37 174.07 10.63 Favored 'General case' 0 C--N 1.283 -2.31 0 N-CA-C 113.434 0.902 . . . . 64.219999999999999 113.434 -169.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.579 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 41.0 t -103.6 154.09 19.88 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.096 -0.956 . . . . 72.530000000000001 111.779 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -69.49 -17.26 63.59 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.285 -0.871 . . . . 72.409999999999997 109.853 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.42 -46.28 33.68 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.875 -0.602 . . . . 72.310000000000002 109.725 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 524' ' ' SER . 13.5 pt-20 -71.57 -28.64 63.98 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.867 -0.79 . . . . 74.430000000000007 108.867 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . 0.578 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 23.4 ttt -59.27 -51.64 69.07 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.392 -0.822 . . . . 75.239999999999995 109.213 174.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.92 -35.92 82.26 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.435 -0.802 . . . . 70.310000000000002 110.144 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.98 -47.79 83.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.533 -0.758 . . . . 71.430000000000007 110.583 175.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.15 -35.72 72.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.46 -0.336 . . . . 71.409999999999997 110.889 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 528' ' ' MET . 77.4 mt -67.89 -38.1 82.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.165 0.507 . . . . 73.430000000000007 110.018 178.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 48.2 ttm -70.41 -14.43 62.55 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.152 0.977 . . . . 54.229999999999997 110.803 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 70.64 36.97 67.73 Favored Glycine 0 C--N 1.282 -2.455 0 CA-C-N 114.313 -1.312 . . . . 75.209999999999994 110.579 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -57.67 135.07 52.09 Favored Glycine 0 N--CA 1.416 -2.692 0 O-C-N 124.479 0.752 . . . . 44.240000000000002 111.408 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 10.0 t -72.9 123.82 24.2 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-O 121.826 0.822 . . . . 65.319999999999993 110.877 -177.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 5.7 tt -127.76 94.34 3.93 Favored 'General case' 0 C--N 1.278 -2.524 0 N-CA-C 105.562 -2.014 . . . . 72.430000000000007 105.562 177.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -120.27 95.81 4.89 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-O 122.218 1.009 . . . . 71.340000000000003 108.566 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -87.97 107.3 18.65 Favored 'General case' 0 N--CA 1.426 -1.663 0 CA-C-N 114.803 -1.09 . . . . 50.210000000000001 108.922 -177.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.437 HD22 ' O ' ' A' ' 540' ' ' LEU . 0.0 OUTLIER -67.32 115.19 6.7 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.81 0.814 . . . . 61.310000000000002 110.552 178.098 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 . . . . . 0 N--CA 1.426 -1.642 0 N-CA-C 107.592 -1.262 . . . . 74.129999999999995 107.592 -178.553 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 88.6 mtp . . . . . 0 CA--C 1.508 -0.65 0 N-CA-C 108.041 -1.096 . . . . 75.319999999999993 108.041 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.09 144.6 89.61 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.909 2.406 . . . . 71.329999999999998 113.021 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.36 -8.33 17.29 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.918 2.412 . . . . 73.420000000000002 112.021 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 23.4 p -86.94 -177.27 6.02 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 123.595 0.758 . . . . 72.340000000000003 109.211 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -68.08 112.29 4.96 Favored 'General case' 0 CA--C 1.5 -0.966 0 C-N-CA 120.149 -0.62 . . . . 44.299999999999997 110.117 175.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.6 t -61.18 148.86 8.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 124.426 1.09 . . . . 74.409999999999997 110.894 -178.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.599 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 8.0 ptp180 -83.89 65.35 8.58 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 122.024 0.916 . . . . 72.310000000000002 112.062 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -103.34 6.23 37.77 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.118 -0.946 . . . . 75.140000000000001 111.225 -178.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 38.4 m -107.91 155.08 20.69 Favored 'General case' 0 N--CA 1.415 -2.185 0 N-CA-C 108.852 -0.795 . . . . 52.140000000000001 108.852 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -132.57 141.18 45.8 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.379 0 N-CA-C 106.99 -1.485 . . . . 73.349999999999994 106.99 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . 0.467 ' HD3' ' CZ ' ' A' ' 492' ' ' PHE . 33.5 ttp180 -116.24 123.61 48.15 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.863 -0.792 . . . . 74.239999999999995 108.863 173.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.458 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 1.6 mt -97.5 135.14 39.78 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 105.82 -1.919 . . . . 75.430000000000007 105.82 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -136.39 135.0 38.41 Favored 'General case' 0 C--N 1.287 -2.126 0 C-N-CA 119.771 -0.772 . . . . 50.329999999999998 110.889 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 107.11 23.97 6.78 Favored Glycine 0 N--CA 1.432 -1.627 0 N-CA-C 110.399 -1.081 . . . . 52.009999999999998 110.399 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.72 144.61 97.88 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 112.965 0.728 . . . . 73.030000000000001 112.965 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -55.19 149.54 44.25 Favored 'Trans proline' 0 CA--C 1.492 -1.591 0 C-N-CA 123.107 2.538 . . . . 63.009999999999998 112.182 175.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -77.34 106.63 9.21 Favored 'General case' 1 N--CA 1.37 -4.465 0 N-CA-C 106.123 -1.806 . . . . 63.240000000000002 106.123 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 92.52 31.19 0.01 OUTLIER 'General case' 0 C--N 1.282 -2.343 0 CA-C-N 111.299 -2.682 . . . . 62.43 112.469 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -70.7 117.32 12.07 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.269 -1.382 . . . . 75.430000000000007 107.269 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.0 p -88.25 173.94 8.49 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.063 0.459 . . . . 65.310000000000002 111.722 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.505 ' HA ' HG22 ' A' ' 461' ' ' ILE . 2.5 pp -64.02 -18.55 22.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.55 0.69 . . . . 72.109999999999999 111.881 175.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -79.85 -40.43 28.45 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 109.221 -0.659 . . . . 72.219999999999999 109.221 175.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.3 -43.58 94.28 Favored 'General case' 0 CA--C 1.497 -1.069 0 CA-C-N 115.859 -0.61 . . . . 53.009999999999998 110.731 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.505 HG22 ' HA ' ' A' ' 458' ' ' ILE . 15.9 tt -68.93 -32.83 56.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.572 -0.74 . . . . 74.25 111.173 -176.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.448 HD23 ' O ' ' A' ' 458' ' ' ILE . 3.9 mm? -74.54 -36.3 63.14 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.79 0.328 . . . . 64.209999999999994 110.679 176.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.13 -47.97 82.19 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 108.789 -0.819 . . . . 74.120000000000005 108.789 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -52.56 -42.06 64.11 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 113.461 -1.699 . . . . 73.109999999999999 111.37 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 493' ' ' ILE . 83.0 mt -63.63 -37.17 86.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.924 -0.58 . . . . 60.219999999999999 112.391 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 71.36 -130.33 18.4 Favored Glycine 0 CA--C 1.484 -1.844 0 C-N-CA 119.773 -1.203 . . . . 62.420000000000002 111.765 -177.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.92 -26.67 66.12 Favored 'General case' 0 C--N 1.274 -2.689 0 C-N-CA 124.463 1.105 . . . . 74.519999999999996 112.093 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -71.38 -11.73 61.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 73.430000000000007 111.511 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -70.36 -15.54 62.87 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.16 -0.473 . . . . 51.009999999999998 111.48 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.2 m -78.2 -28.05 47.95 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-O 121.099 0.476 . . . . 74.150000000000006 110.253 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -100.46 10.8 40.7 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.623 0.725 . . . . 74.109999999999999 111.507 -172.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 13.4 tt -67.94 142.92 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 N-CA-C 109.504 -0.554 . . . . 74.239999999999995 109.504 178.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 495' ' ' MET . 1.6 tpt180 -66.67 155.8 36.98 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 107.898 -1.149 . . . . 53.329999999999998 107.898 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 86.9 m -64.46 106.66 1.18 Allowed 'General case' 0 C--N 1.296 -1.744 0 O-C-N 123.403 0.439 . . . . 74.430000000000007 109.995 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 12.2 m170 64.2 27.78 13.96 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.988 0.915 . . . . 74.450000000000003 109.859 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -67.5 -19.32 70.74 Favored Glycine 0 C--N 1.337 0.621 0 CA-C-N 114.955 -1.021 . . . . 60.140000000000001 114.055 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 6.4 p -76.2 118.88 23.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-O 121.455 0.645 . . . . 63.509999999999998 110.403 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -134.07 111.49 10.4 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.809 -0.811 . . . . 74.209999999999994 108.809 -178.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 76.4 mtp -88.31 139.57 30.35 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.727 -0.789 . . . . 73.230000000000004 109.311 179.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 60.0 t -83.71 100.96 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 108.27 -1.011 . . . . 73.209999999999994 108.27 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.45 146.82 23.84 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.69 -1.226 . . . . 75.209999999999994 107.69 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -89.17 -172.97 3.86 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 108.304 -0.999 . . . . 64.400000000000006 108.304 -176.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -63.61 -26.83 68.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.104 0.478 . . . . 61.530000000000001 111.048 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -74.87 -7.21 52.82 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-O 121.482 0.658 . . . . 73.150000000000006 110.763 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 73.0 30.9 62.55 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.793 -0.523 . . . . 71.239999999999995 111.793 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -131.06 150.75 77.46 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 106.993 -1.484 . . . . 73.109999999999999 106.993 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.42 125.04 17.56 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 122.968 2.445 . . . . 53.450000000000003 114.2 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 38.4 m -69.31 -28.62 66.42 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.276 -0.875 . . . . 70.420000000000002 110.246 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 133.41 -21.07 4.1 Favored Glycine 0 CA--C 1.493 -1.307 0 CA-C-N 115.59 -0.732 . . . . 52.439999999999998 111.526 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . 0.458 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 20.3 p-10 -110.72 151.87 27.23 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.336 0.589 . . . . 64.219999999999999 111.302 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -152.77 155.27 36.86 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.662 -0.866 . . . . 64.219999999999999 108.662 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . 0.467 ' CZ ' ' HD3' ' A' ' 448' ' ' ARG . 77.6 m-85 -111.48 142.11 44.18 Favored 'General case' 0 C--N 1.284 -2.255 0 CA-C-O 121.063 0.459 . . . . 73.530000000000001 110.456 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 465' ' ' LEU . 67.8 mt -126.8 139.72 51.02 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 105.399 -2.074 . . . . 62.450000000000003 105.399 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -121.16 136.16 55.03 Favored 'General case' 0 C--N 1.274 -2.715 0 C-N-CA 119.905 -0.718 . . . . 64.400000000000006 109.443 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.402 ' O ' ' HD3' ' A' ' 473' ' ' ARG . 0.2 OUTLIER -103.9 173.7 6.19 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 123.686 0.616 . . . . 72.040000000000006 110.242 176.401 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -70.26 -42.08 72.62 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-O 121.197 0.522 . . . . 73.219999999999999 110.103 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 500' ' ' ARG . 36.6 t -130.38 156.82 44.08 Favored 'General case' 0 N--CA 1.412 -2.331 0 CA-C-N 115.587 -0.733 . . . . 61.149999999999999 111.141 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.45 -28.36 66.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.79 -1.095 . . . . 75.420000000000002 111.262 -177.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.21 -47.82 84.35 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 116.185 -0.461 . . . . 75.540000000000006 111.434 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 497' ' ' SER . 0.5 OUTLIER -74.18 -32.75 63.2 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.031 -0.668 . . . . 74.120000000000005 111.076 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.34 96.34 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 123.447 0.467 . . . . 73.540000000000006 110.352 177.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -65.65 -42.6 91.24 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.869 -0.605 . . . . 74.310000000000002 110.038 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 16.0 tpt -67.91 -37.62 81.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.01 -0.541 . . . . 65.420000000000002 110.508 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.62 92.8 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.322 -0.399 . . . . 73.049999999999997 109.98 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -66.84 -38.71 86.93 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-O 120.72 0.295 . . . . 72.200000000000003 111.022 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -67.32 -41.38 85.38 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.831 0.348 . . . . 60.25 110.583 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -68.38 -39.59 81.69 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.869 -0.605 . . . . 54.039999999999999 110.79 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . 0.6 ' HA ' ' HB2' ' A' ' 511' ' ' LYS . 49.1 m -99.35 14.22 30.45 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 113.187 0.81 . . . . 71.129999999999995 113.187 -175.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -64.83 105.01 0.92 Allowed 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.013 -0.736 . . . . 64.340000000000003 109.013 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt 69.9 20.5 6.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.613 1.165 . . . . 61.530000000000001 111.648 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . 0.6 ' HB2' ' HA ' ' A' ' 508' ' ' CYS . 26.5 tptp -70.83 142.17 51.29 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 124.073 0.949 . . . . 71.299999999999997 109.076 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -97.97 143.28 28.71 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 119.319 -0.952 . . . . 62.109999999999999 110.848 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 44.3 ttm -111.16 114.32 27.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 104.544 -2.391 . . . . 72.129999999999995 104.544 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 97.4 mttt 67.16 -85.42 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.344 1.027 . . . . 64.409999999999997 109.011 -172.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -137.73 -8.89 1.63 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.466 0.65 . . . . 75.439999999999998 111.043 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -92.3 135.17 34.24 Favored 'General case' 0 CA--C 1.485 -1.524 0 N-CA-C 109.0 -0.741 . . . . 74.400000000000006 109.0 -175.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -87.01 132.25 33.85 Favored 'General case' 0 C--N 1.259 -3.335 0 CA-C-N 115.586 -0.734 . . . . 74.319999999999993 109.678 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 57.6 t -122.43 127.3 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 N-CA-C 108.727 -0.842 . . . . 70.519999999999996 108.727 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -93.68 115.6 28.06 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.742 -1.207 . . . . 73.340000000000003 107.742 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . 0.422 HG22 HD22 ' A' ' 449' ' ' LEU . 94.3 t -104.34 127.06 58.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 CA-C-N 116.392 -0.367 . . . . 62.020000000000003 110.93 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -131.53 150.91 51.98 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.008 -0.542 . . . . 75.329999999999998 110.766 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -82.7 156.63 23.69 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.168 0.587 . . . . 62.049999999999997 110.098 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 66.0 m -157.23 166.56 32.82 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 122.966 0.506 . . . . 74.140000000000001 110.163 -176.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 58.5 p -97.06 155.28 16.87 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.916 -0.584 . . . . 65.310000000000002 110.32 177.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.45 62.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.127 -0.488 . . . . 53.119999999999997 111.688 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.99 -45.91 66.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.575 -0.528 . . . . 74.549999999999997 109.575 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.06 -41.7 97.26 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.418 0.628 . . . . 74.129999999999995 109.58 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -60.39 -44.41 95.69 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.788 -1.096 . . . . 73.310000000000002 110.81 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.13 -40.74 78.09 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.657 -0.498 . . . . 71.0 109.657 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.3 -41.94 97.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.903 -0.59 . . . . 72.120000000000005 110.986 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 96.0 t -72.6 -35.85 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 120.71 -0.396 . . . . 74.349999999999994 110.766 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 78.6 mt -76.29 -19.37 58.34 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.302 0.573 . . . . 71.340000000000003 111.399 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 3.9 tpt -82.71 -8.8 59.57 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 122.308 1.051 . . . . 53.520000000000003 109.018 177.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 69.49 28.92 71.86 Favored Glycine 0 C--N 1.297 -1.628 0 CA-C-N 114.022 -1.445 . . . . 55.439999999999998 111.241 -177.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -77.96 142.87 26.99 Favored Glycine 0 N--CA 1.396 -3.983 0 N-CA-C 111.545 -0.622 . . . . 45.100000000000001 111.545 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 77.9 m -147.61 137.84 23.03 Favored 'General case' 0 C--N 1.289 -2.049 0 N-CA-C 108.03 -1.1 . . . . 70.400000000000006 108.03 176.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 56.6 tp -110.05 123.9 50.51 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 116.161 -0.472 . . . . 73.129999999999995 109.937 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -78.91 109.23 13.0 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.1 -0.5 . . . . 61.100000000000001 109.998 176.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -140.26 95.46 2.89 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.936 -0.764 . . . . 75.400000000000006 108.936 176.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 51.5 tp -86.37 89.37 7.85 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.054 -1.461 . . . . 72.439999999999998 107.054 177.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 . . . . . 0 N--CA 1.429 -1.489 0 CA-C-N 115.152 -0.931 . . . . 34.439999999999998 108.729 -174.781 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 50.5 ttm . . . . . 0 CA--C 1.503 -0.86 0 N-CA-C 108.82 -0.807 . . . . 74.510000000000005 108.82 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -58.99 127.8 25.56 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.169 1.913 . . . . 65.299999999999997 109.669 174.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -52.12 113.17 1.07 Allowed 'Trans proline' 0 C--O 1.245 0.826 0 C-N-CA 122.711 2.274 . . . . 74.310000000000002 110.859 177.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 29.1 m 66.18 75.16 0.34 Allowed 'General case' 0 N--CA 1.439 -0.977 0 O-C-N 124.513 1.133 . . . . 72.519999999999996 110.258 -174.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 34.0 p30 -76.22 143.42 41.03 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.569 -1.196 . . . . 72.430000000000007 109.473 177.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 52.5 t -119.43 142.45 34.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 108.674 -0.862 . . . . 63.340000000000003 108.674 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.601 ' HA ' ' HA ' ' A' ' 524' ' ' SER . 32.3 mtp180 -93.67 67.82 3.92 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 119.645 -0.822 . . . . 73.099999999999994 109.353 178.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -99.2 12.54 35.88 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.589 -0.732 . . . . 73.099999999999994 110.966 -175.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 27.8 m -117.03 149.5 40.18 Favored 'General case' 0 N--CA 1.412 -2.325 0 N-CA-C 108.646 -0.872 . . . . 63.310000000000002 108.646 -178.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . 0.723 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.3 mt -126.96 151.03 33.33 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.76 0 N-CA-C 107.056 -1.461 . . . . 53.020000000000003 107.056 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -125.36 124.81 42.35 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.808 -1.182 . . . . 73.109999999999999 107.808 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 490' ' ' ASP . 15.2 mt -100.78 142.66 31.94 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 107.117 -1.438 . . . . 73.140000000000001 107.117 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -144.3 126.99 16.14 Favored 'General case' 0 C--N 1.284 -2.263 0 CA-C-O 121.849 0.833 . . . . 74.409999999999997 110.669 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 108.63 32.75 3.05 Favored Glycine 0 C--N 1.279 -2.637 0 CA-C-N 114.754 -1.112 . . . . 61.43 110.781 -177.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 95.4 mt -59.98 140.93 90.23 Favored Pre-proline 0 C--O 1.241 0.616 0 N-CA-C 112.07 0.396 . . . . 73.140000000000001 112.07 -179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 452' ' ' LEU . 27.4 Cg_exo -61.08 170.57 4.75 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.104 2.536 . . . . 63.539999999999999 113.874 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -77.95 93.13 4.38 Favored 'General case' 0 N--CA 1.403 -2.785 0 CA-C-N 113.573 -1.649 . . . . 72.329999999999998 109.694 178.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 83.06 28.89 0.09 Allowed 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 113.007 -1.906 . . . . 70.030000000000001 112.695 171.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -61.4 132.67 54.25 Favored 'General case' 0 C--O 1.246 0.907 0 N-CA-C 108.686 -0.857 . . . . 65.530000000000001 108.686 173.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 73.1 p -95.97 176.52 6.08 Favored 'General case' 0 N--CA 1.418 -2.028 0 CA-C-O 121.695 0.759 . . . . 74.409999999999997 112.362 -174.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 462' ' ' LEU . 31.9 pt -65.02 -26.32 39.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.06 0 CA-C-N 115.071 -0.968 . . . . 74.019999999999996 111.536 176.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -76.85 -32.29 57.43 Favored 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 119.473 -0.891 . . . . 74.450000000000003 110.19 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.84 -42.35 99.71 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.984 -0.553 . . . . 72.120000000000005 110.15 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.402 HG22 ' O ' ' A' ' 458' ' ' ILE . 11.8 tt -69.03 -36.03 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 120.606 -0.437 . . . . 71.450000000000003 110.666 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 97.6 mt -67.49 -38.99 85.19 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 120.951 0.405 . . . . 73.230000000000004 110.246 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -62.51 -51.3 67.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.464 -0.789 . . . . 63.5 109.327 177.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 94.4 t80 -55.94 -39.4 71.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 113.912 -1.495 . . . . 75.340000000000003 111.42 -178.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 71.5 mt -71.31 -32.78 69.02 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.765 -0.652 . . . . 63.210000000000001 112.666 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 73.28 -134.06 19.07 Favored Glycine 0 CA--C 1.48 -2.101 0 C-N-CA 119.252 -1.452 . . . . 51.109999999999999 111.244 -178.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -64.55 -21.57 66.73 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-N 114.629 -0.785 . . . . 53.149999999999999 111.158 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -67.08 -14.18 62.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.277 0.56 . . . . 74.329999999999998 110.535 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . 0.429 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -71.27 -14.84 62.36 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.025 -0.534 . . . . 63.219999999999999 111.151 177.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 27.7 m -84.17 -23.98 30.37 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-O 121.776 0.798 . . . . 72.010000000000005 109.028 176.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -90.92 -11.27 39.62 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.44 -0.8 . . . . 72.340000000000003 111.999 -175.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 469' ' ' ALA . 9.5 tt -77.17 132.92 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 N-CA-C 108.868 -0.79 . . . . 52.530000000000001 108.868 176.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 -72.71 159.34 33.97 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.942 -0.392 . . . . 71.099999999999994 109.942 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 72.1 m -57.18 113.1 1.58 Allowed 'General case' 0 C--O 1.246 0.92 0 CA-C-O 121.286 0.565 . . . . 75.319999999999993 111.761 -174.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 62.82 37.35 12.38 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 114.329 -1.305 . . . . 75.120000000000005 108.764 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -70.46 -14.29 71.84 Favored Glycine 0 N--CA 1.436 -1.356 0 CA-C-N 115.062 -0.972 . . . . 62.149999999999999 111.707 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 492' ' ' PHE . 4.2 p -83.38 101.85 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.87 0 CA-C-O 122.089 0.947 . . . . 74.310000000000002 110.588 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -107.78 101.87 11.13 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.45 -0.944 . . . . 75.450000000000003 108.45 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . 0.511 ' SD ' ' HB3' ' A' ' 487' ' ' PRO . 46.5 ttm -80.59 137.09 36.35 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 120.908 0.385 . . . . 51.399999999999999 110.95 -177.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 59.5 t -90.36 111.46 23.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 CA-C-N 115.682 -0.69 . . . . 44.009999999999998 110.529 -177.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 2.2 pp -92.91 156.9 16.65 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.289 -0.868 . . . . 51.439999999999998 110.415 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -97.21 -169.03 1.79 Allowed 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.891 -1.522 . . . . 63.020000000000003 106.891 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -60.02 -30.17 68.99 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 123.342 0.657 . . . . 70.439999999999998 111.49 -178.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -73.63 -17.83 61.11 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.039 0.447 . . . . 73.420000000000002 110.891 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 89.77 19.41 47.98 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.481 -0.866 . . . . 71.5 111.884 -177.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.456 ' HD3' ' O ' ' A' ' 487' ' ' PRO . 0.1 OUTLIER -118.85 146.7 40.71 Favored Pre-proline 0 N--CA 1.445 -0.676 0 N-CA-C 107.211 -1.403 . . . . 75.510000000000005 107.211 179.252 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . 0.511 ' HB3' ' SD ' ' A' ' 479' ' ' MET . 10.2 Cg_endo -53.39 133.2 52.15 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 C-N-CA 123.325 2.684 . . . . 75.340000000000003 113.265 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 21.1 m -80.02 0.02 33.54 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.674 0.75 . . . . 74.340000000000003 109.509 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 94.02 2.07 64.73 Favored Glycine 0 N--CA 1.426 -1.998 0 N-CA-C 110.411 -1.076 . . . . 53.520000000000003 110.411 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . 0.503 ' HA ' ' O ' ' A' ' 449' ' ' LEU . 18.0 t70 -114.61 146.19 41.11 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.313 -1.366 . . . . 74.040000000000006 107.313 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -160.17 162.59 33.92 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 109.619 -0.512 . . . . 64.409999999999997 109.619 -177.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 87.3 m-85 -115.73 145.87 42.4 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 120.646 0.26 . . . . 71.150000000000006 110.558 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.1 mt -118.07 134.88 60.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 105.988 -1.856 . . . . 74.439999999999998 105.988 172.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -118.72 109.66 16.35 Favored 'General case' 0 C--N 1.27 -2.861 0 N-CA-C 109.414 -0.587 . . . . 73.120000000000005 109.414 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.723 ' SD ' HD11 ' A' ' 447' ' ' ILE . 71.8 mtp -104.11 169.15 8.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.957 -0.565 . . . . 74.349999999999994 111.043 -175.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.22 -53.13 60.76 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 123.441 0.697 . . . . 74.0 111.775 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -121.2 146.04 47.2 Favored 'General case' 0 N--CA 1.419 -2.009 0 CA-C-N 115.669 -0.696 . . . . 64.340000000000003 112.142 -169.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.96 66.57 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-N 114.949 -1.023 . . . . 72.310000000000002 109.997 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -68.17 -46.91 69.45 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 122.103 0.954 . . . . 74.420000000000002 109.339 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -68.71 -38.78 80.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 114.02 -1.446 . . . . 75.040000000000006 109.274 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -66.14 -38.32 87.85 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.33 -0.85 . . . . 73.129999999999995 110.603 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -64.27 -42.54 96.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.585 -0.524 . . . . 73.430000000000007 109.585 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 91.3 mtp -61.88 -43.41 98.91 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.389 -0.369 . . . . 71.439999999999998 110.244 178.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.3 96.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.494 -0.775 . . . . 73.010000000000005 110.7 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.11 -30.28 67.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.969 0.414 . . . . 43.32 111.382 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -46.56 64.01 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.866 -0.606 . . . . 64.530000000000001 110.247 176.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . 0.577 ' HE3' ' HA ' ' A' ' 507' ' ' LYS . 1.4 tpmt? -75.7 -31.99 59.92 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.085 0.469 . . . . 73.409999999999997 110.582 -175.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 44.1 m -96.41 9.14 42.2 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 120.967 0.413 . . . . 65.409999999999997 111.918 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -63.47 101.85 0.37 Allowed 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.294 -0.632 . . . . 73.120000000000005 109.294 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 54.54 66.52 1.21 Allowed 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.532 1.533 . . . . 71.099999999999994 110.138 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -97.11 141.89 29.71 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 113.634 -1.621 . . . . 51.020000000000003 109.49 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.424 ' HA ' ' O ' ' A' ' 516' ' ' ARG . 0.8 OUTLIER -92.72 116.53 29.1 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 108.214 -1.032 . . . . 71.409999999999997 108.214 175.115 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 26.0 ttt -103.6 103.91 13.91 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 107.336 -1.357 . . . . 71.230000000000004 107.336 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 89.0 mttt 67.57 -77.91 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.372 1.069 . . . . 75.439999999999998 109.791 -175.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -135.4 -12.17 2.11 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 123.444 0.697 . . . . 60.219999999999999 110.926 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . 0.424 ' O ' ' HA ' ' A' ' 512' ' ' ASN . 28.2 tpt180 -88.83 152.75 21.57 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.035 -0.53 . . . . 72.140000000000001 109.723 -172.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.82 118.21 36.02 Favored 'General case' 0 C--N 1.291 -1.96 0 N-CA-C 107.356 -1.35 . . . . 72.439999999999998 107.356 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 60.0 t -114.5 116.98 54.2 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 109.046 -0.724 . . . . 53.240000000000002 109.046 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -95.95 110.87 23.01 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.604 -0.887 . . . . 63.310000000000002 108.604 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.51 135.21 44.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-N 115.999 -0.546 . . . . 62.009999999999998 111.868 -177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -126.35 162.22 26.02 Favored 'General case' 0 C--O 1.215 -0.728 0 C-N-CA 124.35 1.06 . . . . 72.129999999999995 109.19 176.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -100.71 157.61 16.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.815 -0.809 . . . . 73.239999999999995 108.815 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.1 p -156.68 163.43 39.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-O 121.892 0.853 . . . . 65.219999999999999 111.501 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 3.6 m -97.74 158.81 15.3 Favored 'General case' 0 C--N 1.271 -2.839 0 CA-C-N 114.722 -1.126 . . . . 63.509999999999998 108.555 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -57.24 -33.88 68.02 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 122.019 0.914 . . . . 72.230000000000004 108.869 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.4 -41.34 98.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.375 -1.284 . . . . 64.430000000000007 110.29 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . 0.434 ' O ' HG23 ' A' ' 531' ' ' VAL . 38.3 mt-10 -69.95 -36.53 75.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.213 -0.448 . . . . 73.450000000000003 110.095 178.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 46.2 ttm -63.7 -43.7 95.84 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.162 -0.681 . . . . 63.0 109.162 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -61.55 -40.28 94.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.212 -0.904 . . . . 74.140000000000001 109.593 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -63.69 -41.3 98.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.994 -0.548 . . . . 63.229999999999997 110.643 177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' A' ' 535' ' ' GLY . 98.9 t -65.35 -31.44 53.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.143 0.497 . . . . 63.219999999999999 110.499 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 91.8 mt -78.67 -37.6 41.46 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 121.317 0.579 . . . . 73.439999999999998 111.126 175.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 23.7 ttt -77.62 -40.41 42.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.948 0.88 . . . . 72.450000000000003 113.335 -174.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -118.08 -37.18 0.89 Allowed Glycine 1 C--N 1.25 -4.212 0 CA-C-N 114.383 -1.28 . . . . 71.230000000000004 113.023 -175.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' A' ' 531' ' ' VAL . . . 121.05 -171.24 14.77 Favored Glycine 0 N--CA 1.425 -2.043 0 N-CA-C 110.852 -0.899 . . . . 55.240000000000002 110.852 179.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.5 t -79.92 80.73 6.29 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-O 123.609 1.671 . . . . 72.140000000000001 109.18 175.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 55.9 tp -116.7 100.5 7.86 Favored 'General case' 0 C--N 1.27 -2.861 0 CA-C-N 112.359 -2.2 . . . . 73.349999999999994 110.113 -175.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -108.15 93.37 4.5 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 107.565 -1.272 . . . . 72.340000000000003 107.565 174.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -121.85 120.89 35.85 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 115.19 -0.914 . . . . 73.430000000000007 109.544 -172.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 28.4 tp -145.23 35.59 1.09 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 123.215 1.483 . . . . 75.310000000000002 108.596 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 . . . . . 0 C--N 1.273 -2.729 0 CA-C-N 112.963 -1.926 . . . . 72.430000000000007 107.031 179.674 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 25.0 ptt? . . . . . 0 C--O 1.221 -0.439 0 N-CA-C 108.64 -0.874 . . . . 73.439999999999998 108.64 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -86.44 111.15 1.0 Allowed 'Trans proline' 0 N--CA 1.439 -1.679 0 C-N-CA 121.504 1.469 . . . . 72.010000000000005 111.612 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -82.84 11.91 3.09 Favored 'Trans proline' 0 C--O 1.252 1.192 0 C-N-CA 123.457 2.772 . . . . 54.009999999999998 110.912 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 10.4 m -70.31 173.45 6.78 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 126.458 1.903 . . . . 73.510000000000005 108.43 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -69.81 87.73 0.53 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.624 0.725 . . . . 62.32 110.171 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 60.5 t -123.81 111.06 27.53 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 106.377 -1.712 . . . . 71.5 106.377 174.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.595 ' HA ' ' HA ' ' A' ' 524' ' ' SER 0.258 9.4 ptm85 -92.98 73.95 4.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 114.51 1.3 . . . . 72.230000000000004 114.51 -176.265 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.66 9.27 17.8 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.097 -0.956 . . . . 52.450000000000003 108.898 177.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 17.2 m -107.53 143.88 35.31 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 115.507 -0.769 . . . . 73.099999999999994 108.926 -176.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . 0.45 HD11 ' SD ' ' A' ' 495' ' ' MET . 3.2 mt -120.95 148.49 24.17 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.79 0 C-N-CA 123.758 0.823 . . . . 71.329999999999998 110.09 -176.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -126.58 122.52 35.3 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 107.254 -1.388 . . . . 74.150000000000006 107.254 176.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.595 HD22 HG22 ' A' ' 520' ' ' VAL . 27.5 mt -108.55 153.71 22.98 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.267 -0.642 . . . . 64.430000000000007 109.267 -175.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . 0.426 ' HD2' ' OE2' ' A' ' 519' ' ' GLU . 32.6 ttm180 -142.15 147.56 36.85 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 107.402 -1.332 . . . . 61.399999999999999 107.402 172.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 86.24 34.61 12.08 Favored Glycine 0 C--N 1.306 -1.124 0 C-N-CA 120.304 -0.95 . . . . 61.530000000000001 114.045 175.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 86.4 mt -82.3 142.34 47.01 Favored Pre-proline 0 C--N 1.302 -1.476 0 N-CA-C 109.015 -0.735 . . . . 74.420000000000002 109.015 174.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -53.58 163.74 2.56 Favored 'Trans proline' 0 C--O 1.252 1.221 0 C-N-CA 123.126 2.551 . . . . 75.530000000000001 112.721 176.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -71.95 93.48 1.36 Allowed 'General case' 0 N--CA 1.412 -2.35 0 CA-C-N 114.538 -1.21 . . . . 74.329999999999998 110.094 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 78.66 36.46 0.19 Allowed 'General case' 0 C--N 1.283 -2.295 0 CA-C-N 112.105 -2.316 . . . . 53.329999999999998 111.815 171.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -57.51 130.95 48.63 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.924 -1.139 . . . . 62.020000000000003 107.924 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.89 164.63 26.35 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-O 120.827 0.346 . . . . 41.549999999999997 110.439 -173.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.443 ' O ' HG22 ' A' ' 461' ' ' ILE . 61.0 mt -62.44 -35.43 69.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.848 0.832 . . . . 73.400000000000006 109.686 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -69.17 -29.96 68.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.762 -0.654 . . . . 61.140000000000001 110.512 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.62 -39.15 70.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.431 -0.804 . . . . 74.040000000000006 110.657 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 458' ' ' ILE . 13.4 tt -74.99 -33.41 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 116.237 -0.438 . . . . 55.140000000000001 110.455 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.26 -36.2 79.05 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.236 0.541 . . . . 74.400000000000006 110.059 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -61.11 -50.96 71.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.026 -0.988 . . . . 73.430000000000007 108.886 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -55.73 -38.85 70.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 113.847 -1.524 . . . . 62.43 111.739 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 87.1 mt -64.42 -35.27 80.36 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.114 -0.494 . . . . 62.140000000000001 111.901 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 68.52 -132.65 27.42 Favored Glycine 0 CA--C 1.48 -2.102 0 C-N-CA 119.776 -1.202 . . . . 51.409999999999997 112.685 178.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.97 -32.3 45.41 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.131 -1.035 . . . . 73.129999999999995 112.242 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -69.34 -14.38 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.083 0.468 . . . . 72.140000000000001 111.88 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . 0.492 ' O ' HG22 ' A' ' 472' ' ' ILE . . . -69.96 -15.45 63.04 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.016 0.436 . . . . 65.420000000000002 110.596 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 21.0 m -77.11 -24.05 51.75 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 122.237 -0.289 . . . . 74.219999999999999 111.757 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . 0.433 ' OD2' ' HB3' ' A' ' 496' ' ' LYS . 30.6 t70 -106.2 -3.13 21.71 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.946 -0.471 . . . . 72.450000000000003 111.728 -178.054 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 469' ' ' ALA . 10.6 tt -59.84 146.11 10.63 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 CA-C-O 120.928 0.394 . . . . 54.329999999999998 110.771 -176.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . 0.454 ' NH2' ' HA ' ' A' ' 496' ' ' LYS . 15.2 tpp180 -74.1 139.38 44.56 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 105.773 -1.936 . . . . 73.25 105.773 175.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 21.4 m -72.03 116.42 12.42 Favored 'General case' 0 C--N 1.278 -2.536 0 N-CA-C 109.655 -0.498 . . . . 72.329999999999998 109.655 -173.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 9.6 m170 67.19 21.93 9.88 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.789 0.835 . . . . 72.030000000000001 111.554 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -82.79 -6.06 88.81 Favored Glycine 0 N--CA 1.439 -1.12 0 CA-C-N 115.252 -0.886 . . . . 61.299999999999997 111.316 177.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 4.4 p -84.44 119.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 CA-C-O 121.169 0.509 . . . . 60.210000000000001 109.921 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -134.69 120.52 19.6 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.05 -0.722 . . . . 72.439999999999998 109.05 -178.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 65.8 mtt -97.59 147.75 23.98 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 108.243 -1.021 . . . . 73.420000000000002 108.243 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.1 t -94.95 109.46 22.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 CA-C-O 121.602 0.715 . . . . 53.439999999999998 110.671 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 487' ' ' PRO . 2.9 mp -98.87 146.49 25.91 Favored 'General case' 0 N--CA 1.427 -1.598 0 N-CA-C 107.545 -1.279 . . . . 64.340000000000003 107.545 172.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -90.08 -179.82 5.76 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.826 -1.546 . . . . 71.25 106.826 -175.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.9 -16.35 64.26 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 114.371 1.248 . . . . 64.340000000000003 114.371 -173.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -81.61 -10.08 59.52 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.515 0.674 . . . . 70.430000000000007 109.484 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 83.72 32.1 25.2 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.513 -0.767 . . . . 75.230000000000004 111.589 -177.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 30.3 mmt180 -119.31 131.87 24.2 Favored Pre-proline 0 C--N 1.309 -1.193 0 N-CA-C 107.959 -1.126 . . . . 74.120000000000005 107.959 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 481' ' ' LEU . 51.4 Cg_exo -57.47 129.76 35.57 Favored 'Trans proline' 0 C--O 1.243 0.76 0 C-N-CA 122.226 1.951 . . . . 74.109999999999999 111.205 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 8.0 p -73.95 -28.44 61.5 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.83 0.824 . . . . 72.530000000000001 108.982 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 120.72 -15.08 9.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 114.89 -1.05 . . . . 65.219999999999999 111.455 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -100.39 161.37 13.64 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 120.932 0.396 . . . . 71.140000000000001 110.155 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -159.38 177.56 10.85 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.923 -0.581 . . . . 73.519999999999996 109.818 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -135.12 143.03 46.35 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 124.566 1.147 . . . . 71.129999999999995 108.657 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 53.7 mt -139.73 135.77 39.17 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.985 0 N-CA-C 107.143 -1.429 . . . . 53.539999999999999 107.143 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -111.59 138.48 48.07 Favored 'General case' 0 C--N 1.272 -2.785 0 C-N-CA 118.934 -1.106 . . . . 75.019999999999996 108.415 175.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.45 ' SD ' HD11 ' A' ' 447' ' ' ILE . 79.0 mtp -104.71 -176.75 3.17 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.724 -0.843 . . . . 61.140000000000001 108.724 175.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.454 ' HA ' ' NH2' ' A' ' 473' ' ' ARG . 3.2 ttmp? -88.21 -39.31 14.57 Favored 'General case' 0 C--N 1.281 -2.384 0 CA-C-O 121.338 0.589 . . . . 61.039999999999999 109.642 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 15.6 m -114.26 141.67 47.27 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 115.1 -0.954 . . . . 74.219999999999999 111.502 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.11 67.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.207 -0.906 . . . . 62.240000000000002 109.02 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -67.27 -45.69 75.87 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-N 114.813 -1.085 . . . . 61.200000000000003 110.544 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -70.76 -36.19 72.98 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.507 -0.77 . . . . 70.349999999999994 110.346 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -61.67 -41.46 97.57 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 123.551 0.532 . . . . 70.140000000000001 110.331 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -62.24 -43.69 98.26 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.918 -0.583 . . . . 71.329999999999998 110.935 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 89.7 mtp -65.05 -41.24 95.35 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.172 -0.467 . . . . 74.049999999999997 110.516 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -64.81 -42.53 94.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.145 -0.48 . . . . 61.520000000000003 110.461 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -67.05 -38.49 85.92 Favored 'General case' 0 C--O 1.195 -1.807 0 CA-C-N 116.134 -0.484 . . . . 63.219999999999999 111.056 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.95 -42.84 72.7 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.476 0.655 . . . . 72.450000000000003 110.072 178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -68.29 -34.31 75.93 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.668 -0.696 . . . . 61.409999999999997 110.55 -177.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 34.7 m -115.1 19.01 16.0 Favored 'General case' 0 N--CA 1.425 -1.714 0 N-CA-C 112.993 0.738 . . . . 71.510000000000005 112.993 -174.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 34.7 t-80 -69.23 93.51 0.62 Allowed 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.511 -0.743 . . . . 71.239999999999995 110.299 176.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.407 ' H ' ' HA ' ' A' ' 519' ' ' GLU . 45.6 tttp 71.0 30.04 2.83 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.399 1.479 . . . . 65.150000000000006 109.717 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.08 141.91 40.03 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.25 -1.341 . . . . 61.140000000000001 108.919 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -77.63 145.79 36.53 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-O 121.256 0.551 . . . . 65.420000000000002 110.797 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 25.6 ttt -129.77 102.17 6.21 Favored 'General case' 0 C--N 1.288 -2.091 0 N-CA-C 106.35 -1.722 . . . . 54.130000000000003 106.35 173.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 66.1 -81.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 124.712 1.205 . . . . 63.450000000000003 111.958 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -134.76 -2.37 2.66 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 123.399 0.68 . . . . 64.209999999999994 112.07 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -115.02 161.39 18.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 107.784 -1.191 . . . . 73.010000000000005 107.784 -176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -113.36 121.43 44.33 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.705 -0.479 . . . . 75.430000000000007 109.705 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 59.2 t -99.11 112.76 32.11 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.183 0 O-C-N 124.161 0.913 . . . . 71.450000000000003 108.638 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . 0.426 ' OE2' ' HD2' ' A' ' 450' ' ' ARG . 49.7 mt-10 -96.29 112.71 24.36 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.146 -1.057 . . . . 71.420000000000002 108.146 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . 0.595 HG22 HD22 ' A' ' 449' ' ' LEU . 93.6 t -104.38 115.6 46.59 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.24 0 CA-C-N 115.382 -0.827 . . . . 71.209999999999994 109.602 -177.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.99 147.94 32.56 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 108.491 -0.929 . . . . 73.310000000000002 108.491 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -105.34 153.36 21.74 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.259 -1.015 . . . . 72.129999999999995 108.259 -178.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 6.8 p -162.79 168.77 20.94 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.259 0.552 . . . . 72.349999999999994 111.906 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.595 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 69.3 m -91.9 160.14 15.43 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-N 115.359 -0.837 . . . . 62.32 112.444 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -51.73 -36.31 46.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.675 -1.148 . . . . 72.150000000000006 111.667 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -64.59 -51.14 64.27 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 108.967 -0.753 . . . . 73.230000000000004 108.967 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -39.08 90.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.024 -0.535 . . . . 71.219999999999999 111.101 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . 0.512 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 26.2 ttt -66.81 -45.15 79.26 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.906 -0.588 . . . . 73.299999999999997 110.499 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -71.73 -31.56 66.83 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.806 -0.442 . . . . 75.510000000000005 109.806 -176.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -61.31 -47.37 86.24 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 123.899 0.88 . . . . 75.109999999999999 110.588 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 48.4 t -70.39 -35.09 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.332 -0.547 . . . . 72.200000000000003 109.588 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 528' ' ' MET . 92.2 mt -64.22 -42.64 96.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.195 -0.457 . . . . 63.520000000000003 110.822 178.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 22.2 mmt -70.06 -16.17 63.1 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.449 0.643 . . . . 72.219999999999999 111.866 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 77.97 44.07 12.77 Favored Glycine 0 C--N 1.273 -2.93 0 CA-C-N 114.702 -1.136 . . . . 72.409999999999997 111.19 -178.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -62.62 161.05 32.13 Favored Glycine 0 N--CA 1.427 -1.964 0 N-CA-C 111.404 -0.679 . . . . 50.219999999999999 111.404 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.4 m -66.92 110.52 3.37 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.581 0.705 . . . . 70.120000000000005 110.14 -176.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -142.42 92.06 2.38 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.087 -0.96 . . . . 72.030000000000001 108.902 -177.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -137.91 43.66 2.22 Favored 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 103.736 -2.69 . . . . 75.150000000000006 103.736 173.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -68.57 97.9 0.83 Allowed 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 111.749 -2.478 . . . . 61.420000000000002 112.485 -171.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.83 89.15 2.99 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 103.435 -2.802 . . . . 74.430000000000007 103.435 172.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 . . . . . 0 C--N 1.291 -1.949 0 N-CA-C 107.256 -1.387 . . . . 73.209999999999994 107.256 -171.633 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 CA--C 1.505 -0.763 0 N-CA-C 108.511 -0.922 . . . . 52.329999999999998 108.511 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . 0.461 ' HB2' ' O ' ' A' ' 441' ' ' THR . 59.0 Cg_endo -76.6 132.41 13.33 Favored 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 121.897 1.732 . . . . 74.549999999999997 110.802 177.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -61.32 -41.86 38.76 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.143 1.895 . . . . 71.109999999999999 110.592 177.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' A' ' 439' ' ' PRO . 9.4 m -99.21 131.6 45.13 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 106.201 -1.777 . . . . 53.310000000000002 106.201 173.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -70.56 168.46 16.29 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 112.732 0.642 . . . . 73.420000000000002 112.732 -174.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 57.3 t -68.33 142.17 16.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 114.979 -1.009 . . . . 71.400000000000006 109.537 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.54 ' HG3' ' OG ' ' A' ' 524' ' ' SER . 7.6 mpt_? -102.28 67.02 1.02 Allowed 'General case' 0 C--O 1.209 -1.059 0 N-CA-C 110.026 -0.361 . . . . 73.140000000000001 110.026 -176.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -124.82 14.87 8.63 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 112.592 0.59 . . . . 63.109999999999999 112.592 -176.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 20.4 m -108.84 151.64 25.98 Favored 'General case' 0 N--CA 1.413 -2.284 0 N-CA-C 108.462 -0.94 . . . . 21.420000000000002 108.462 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . . . . . . . . . 1.2 mt -126.81 132.55 69.96 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.722 0 N-CA-C 108.655 -0.868 . . . . 71.319999999999993 108.655 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -106.02 121.41 44.07 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 108.356 -0.979 . . . . 75.120000000000005 108.356 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.437 HD22 HG22 ' A' ' 520' ' ' VAL . 18.3 mt -104.45 150.44 24.56 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.684 -1.228 . . . . 72.200000000000003 107.684 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . 0.412 HH21 ' CD ' ' A' ' 519' ' ' GLU . 60.6 ttp180 -146.52 131.63 18.32 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.853 -0.425 . . . . 73.030000000000001 109.853 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 104.32 41.06 2.12 Favored Glycine 0 C--N 1.289 -2.036 0 CA-C-N 115.737 -0.665 . . . . 65.540000000000006 111.653 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.06 130.85 89.38 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.16 . . . . 64.049999999999997 111.388 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.506 ' HB2' ' HB2' ' A' ' 456' ' ' ALA . 37.6 Cg_exo -58.91 156.83 31.39 Favored 'Trans proline' 0 N--CA 1.447 -1.216 0 C-N-CA 122.808 2.339 . . . . 74.319999999999993 112.67 176.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -78.14 93.11 4.5 Favored 'General case' 0 N--CA 1.408 -2.537 0 CA-C-N 114.103 -1.408 . . . . 74.310000000000002 110.006 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 89.83 25.76 0.03 OUTLIER 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 112.732 -2.031 . . . . 72.409999999999997 113.325 172.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 453' ' ' PRO . . . -69.39 135.87 50.9 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.375 -1.342 . . . . 72.150000000000006 107.375 172.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 76.2 p -89.26 174.7 7.69 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-O 120.884 0.373 . . . . 73.430000000000007 111.795 -175.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.454 ' HA ' HG22 ' A' ' 461' ' ' ILE . 72.8 mt -61.48 -38.05 79.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 N-CA-C 108.886 -0.783 . . . . 71.519999999999996 108.886 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -64.73 -37.3 87.14 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.403 -0.817 . . . . 72.319999999999993 110.714 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -68.75 -43.4 75.92 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.061 0.458 . . . . 60.299999999999997 110.437 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 465' ' ' LEU . 12.6 tt -71.85 -33.0 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 CA-C-N 115.839 -0.619 . . . . 53.340000000000003 110.621 -175.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.424 ' HG ' ' HB1' ' A' ' 469' ' ' ALA . 8.1 mp -70.8 -30.64 67.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.9 0.381 . . . . 75.519999999999996 110.9 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.93 -48.23 66.53 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.207 -1.035 . . . . 61.32 108.207 175.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -54.63 -42.74 71.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.17 -1.377 . . . . 75.329999999999998 111.102 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 461' ' ' ILE . 90.0 mt -64.95 -31.66 73.01 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.811 -0.631 . . . . 72.219999999999999 111.811 178.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 85.83 -149.41 23.28 Favored Glycine 0 N--CA 1.422 -2.268 0 C-N-CA 120.51 -0.852 . . . . 72.510000000000005 111.431 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -66.31 -22.52 66.28 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.031 -0.585 . . . . 63.409999999999997 111.005 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -62.81 -17.44 61.24 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.808 -0.633 . . . . 74.150000000000006 111.101 178.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . 0.424 ' HB1' ' HG ' ' A' ' 462' ' ' LEU . . . -67.44 -15.32 63.61 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 116.059 -0.519 . . . . 72.540000000000006 110.979 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.3 m -85.83 -3.27 58.87 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.759 0.79 . . . . 65.310000000000002 109.508 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . 0.439 ' CG ' ' HE ' ' A' ' 500' ' ' ARG . 3.8 m-20 -112.93 13.95 19.65 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.996 -0.547 . . . . 74.319999999999993 110.771 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 15.8 tt -72.07 150.63 8.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.282 -0.872 . . . . 72.400000000000006 109.017 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -80.34 151.84 29.26 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 109.542 -0.54 . . . . 72.120000000000005 109.542 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 1.4 m -59.24 114.41 2.63 Favored 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.881 1.273 . . . . 74.400000000000006 109.704 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 59.93 33.21 21.46 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.746 0.818 . . . . 72.549999999999997 110.726 -178.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -98.35 37.04 3.64 Favored Glycine 0 N--CA 1.432 -1.584 0 CA-C-N 116.059 -0.519 . . . . 73.129999999999995 114.32 -174.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 59.0 t -118.41 111.47 34.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.304 0 N-CA-C 109.016 -0.735 . . . . 71.109999999999999 109.016 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 29.9 m-70 -127.65 100.47 5.99 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.243 0.544 . . . . 62.210000000000001 111.396 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . 0.408 ' HA ' ' CB ' ' A' ' 491' ' ' ALA . 66.7 mtt -82.61 142.75 31.51 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.907 -0.775 . . . . 71.340000000000003 108.907 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 46.9 t -88.01 107.49 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.685 0 N-CA-C 107.214 -1.402 . . . . 62.219999999999999 107.214 176.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.8 pp -93.11 158.51 15.74 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.626 -0.715 . . . . 74.439999999999998 112.458 -178.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -91.93 173.2 7.97 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 106.342 -1.725 . . . . 75.129999999999995 106.342 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -56.05 -27.46 53.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.184 0.447 . . . . 71.439999999999998 111.219 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . 0.435 ' OE1' ' HD2' ' A' ' 486' ' ' ARG . 35.3 tt0 -69.41 -20.23 63.8 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 121.161 0.505 . . . . 72.450000000000003 111.345 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 90.87 25.58 24.49 Favored Glycine 0 N--CA 1.435 -1.403 0 CA-C-O 121.463 0.48 . . . . 13.550000000000001 112.898 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.435 ' HD2' ' OE1' ' A' ' 484' ' ' GLN . 91.3 mtt180 -126.79 144.78 51.2 Favored Pre-proline 0 C--N 1.303 -1.445 0 N-CA-C 108.037 -1.097 . . . . 70.540000000000006 108.037 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -53.17 136.18 61.26 Favored 'Trans proline' 0 C--O 1.245 0.868 0 C-N-CA 123.113 2.542 . . . . 75.319999999999993 113.055 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.2 m -80.01 1.58 27.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.461 -0.79 . . . . 62.109999999999999 111.142 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 116.85 -30.0 6.57 Favored Glycine 0 CA--C 1.488 -1.656 0 N-CA-C 111.235 -0.746 . . . . 72.030000000000001 111.235 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -107.22 152.84 23.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.06 0.457 . . . . 70.409999999999997 110.86 179.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.408 ' CB ' ' HA ' ' A' ' 479' ' ' MET . . . -158.11 169.38 24.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.498 -0.774 . . . . 61.229999999999997 109.184 -176.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -127.71 129.88 47.87 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-N 116.182 -0.463 . . . . 60.439999999999998 109.775 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 43.3 mt -122.27 133.01 69.85 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.378 0 N-CA-C 105.977 -1.86 . . . . 74.340000000000003 105.977 172.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -108.54 136.57 47.92 Favored 'General case' 0 C--N 1.271 -2.812 0 N-CA-C 109.571 -0.529 . . . . 74.519999999999996 109.571 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.72 172.59 6.72 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 123.214 0.606 . . . . 62.130000000000003 111.442 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -65.07 -43.93 90.58 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.179 0.991 . . . . 75.129999999999995 110.181 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 51.0 p -141.03 155.98 46.09 Favored 'General case' 0 N--CA 1.42 -1.943 0 CA-C-N 116.302 -0.408 . . . . 73.5 111.785 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -60.54 -40.88 93.14 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.02 -0.991 . . . . 72.340000000000003 111.392 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.56 -37.84 87.85 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.093 -0.958 . . . . 71.430000000000007 111.932 -174.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . 0.439 ' HE ' ' CG ' ' A' ' 471' ' ' ASP . 26.0 mmm180 -75.94 -40.77 53.39 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.405 -0.816 . . . . 71.400000000000006 109.741 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -63.34 -41.84 98.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.362 -0.835 . . . . 70.450000000000003 111.008 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . 0.404 ' HA ' ' HG3' ' A' ' 522' ' ' GLN . 66.1 t80 -64.6 -40.06 94.84 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.855 -0.611 . . . . 72.5 110.978 -178.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 55.6 ttm -70.32 -37.63 74.76 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.303 -0.559 . . . . 65.109999999999999 110.304 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.004 -0.544 . . . . 34.32 110.644 178.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -70.14 -32.18 70.04 Favored 'General case' 0 C--O 1.204 -1.33 0 CA-C-N 116.076 -0.511 . . . . 74.230000000000004 111.836 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -72.89 -34.8 66.91 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.335 0.588 . . . . 55.329999999999998 109.772 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -68.69 -41.7 78.81 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.438 -0.801 . . . . 73.439999999999998 110.778 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 62.2 m -105.5 20.68 18.48 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 112.558 0.577 . . . . 71.129999999999995 112.558 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.89 92.32 0.23 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.384 0.611 . . . . 63.229999999999997 110.572 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 82.7 tttt 64.31 62.74 0.81 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.501 1.52 . . . . 74.409999999999997 110.041 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -105.82 139.38 40.48 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 113.429 -1.714 . . . . 64.450000000000003 107.763 179.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 517' ' ' TYR . 3.2 p-10 -75.78 140.72 42.5 Favored 'General case' 0 C--N 1.293 -1.879 0 CA-C-O 121.216 0.532 . . . . 72.239999999999995 111.268 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.7 ttt -126.19 90.68 3.23 Favored 'General case' 0 N--CA 1.415 -2.19 0 N-CA-C 105.576 -2.009 . . . . 75.439999999999998 105.576 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp 68.55 -84.86 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.928 -1.487 . . . . 72.439999999999998 110.573 -177.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -107.35 -35.87 6.67 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 115.966 -0.561 . . . . 74.540000000000006 112.082 -177.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 30.4 ttm105 -108.63 153.1 23.89 Favored 'General case' 0 C--N 1.273 -2.76 0 CA-C-N 114.992 -1.003 . . . . 65.0 109.833 -165.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 512' ' ' ASN . 7.6 p90 -101.2 121.29 41.58 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 121.219 0.533 . . . . 70.530000000000001 112.083 -177.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.55 109.97 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.277 0 CA-C-N 114.887 -1.052 . . . . 53.450000000000003 108.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . 0.412 ' CD ' HH21 ' A' ' 450' ' ' ARG . 37.2 mt-10 -89.41 110.86 21.63 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 107.808 -1.182 . . . . 64.200000000000003 107.808 178.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . 0.437 HG22 HD22 ' A' ' 449' ' ' LEU . 85.5 t -104.4 123.43 58.27 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.143 0 CA-C-N 115.874 -0.603 . . . . 73.030000000000001 109.501 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -122.07 135.32 54.8 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.006 -0.739 . . . . 65.140000000000001 109.006 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . 0.404 ' HG3' ' HA ' ' A' ' 502' ' ' PHE . 0.0 OUTLIER -90.85 125.63 35.79 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 106.828 -1.545 . . . . 52.200000000000003 106.828 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 62.4 m -134.49 170.31 15.95 Favored 'General case' 0 C--N 1.284 -2.24 0 CA-C-N 115.348 -0.842 . . . . 50.420000000000002 111.014 -171.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.54 ' OG ' ' HG3' ' A' ' 444' ' ' ARG . 44.4 m -92.69 164.1 13.52 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 116.278 -0.419 . . . . 50.240000000000002 110.721 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -59.91 -23.05 63.19 Favored 'General case' 0 C--O 1.209 -1.063 0 CA-C-N 115.552 -0.749 . . . . 73.209999999999994 111.056 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.55 -50.31 70.0 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.146 -0.479 . . . . 72.400000000000006 110.379 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.6 -40.59 95.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.185 0.517 . . . . 70.120000000000005 110.607 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . 0.506 ' O ' ' HG ' ' A' ' 532' ' ' LEU . 27.8 ttt -67.01 -44.43 80.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.631 -0.713 . . . . 70.349999999999994 110.417 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.13 -35.95 80.82 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-N 116.12 -0.491 . . . . 71.409999999999997 110.164 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -62.73 -46.2 89.17 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.983 -0.553 . . . . 72.310000000000002 110.664 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 58.4 t -74.35 -31.79 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 120.327 -0.549 . . . . 73.099999999999994 110.911 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 528' ' ' MET . 73.3 mt -77.28 -27.14 53.0 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.909 0.385 . . . . 74.439999999999998 110.869 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 25.4 ttt -73.85 -24.03 59.71 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.762 1.268 . . . . 73.329999999999998 108.911 176.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 73.37 -6.03 17.98 Favored Glycine 0 C--N 1.281 -2.521 0 CA-C-N 113.141 -1.845 . . . . 64.25 113.362 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -73.51 136.54 22.28 Favored Glycine 0 N--CA 1.399 -3.78 0 N-CA-C 111.169 -0.772 . . . . 44.219999999999999 111.169 -178.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 44.5 m -151.18 133.54 15.4 Favored 'General case' 0 C--N 1.28 -2.451 0 N-CA-C 107.124 -1.436 . . . . 53.409999999999997 107.124 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 45.4 tp -124.62 61.98 1.14 Allowed 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.085 0.945 . . . . 71.530000000000001 109.107 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -105.49 86.5 2.42 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 107.039 -1.467 . . . . 73.420000000000002 107.039 176.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -160.21 111.12 1.89 Allowed 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 107.928 -1.138 . . . . 73.329999999999998 107.928 -176.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 8.5 mp -71.76 99.5 2.17 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 123.681 0.613 . . . . 62.43 110.414 -178.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 . . . . . 0 C--N 1.301 -1.504 0 N-CA-C 107.616 -1.253 . . . . 74.430000000000007 107.616 -178.899 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 438' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 CA--C 1.504 -0.813 0 N-CA-C 108.675 -0.861 . . . . 72.200000000000003 108.675 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.81 160.57 43.18 Favored 'Trans proline' 0 C--O 1.245 0.858 0 C-N-CA 122.627 2.218 . . . . 74.150000000000006 110.791 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 440' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.83 -5.11 15.67 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.159 1.906 . . . . 72.340000000000003 111.957 -177.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 39.4 m 73.97 150.12 0.11 Allowed 'General case' 0 C--O 1.242 0.661 0 C-N-CA 124.341 1.057 . . . . 70.310000000000002 109.628 -177.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 442' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -81.44 78.66 8.18 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.883 0.849 . . . . 64.209999999999994 109.215 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.61 155.55 7.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-N 113.792 -1.549 . . . . 72.109999999999999 109.522 -176.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' ARG . . . . . 0.657 ' HB2' ' NE2' ' A' ' 522' ' ' GLN . 22.1 ptt180 -87.25 51.91 2.36 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 122.545 1.164 . . . . 75.140000000000001 109.525 176.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -101.93 9.25 40.72 Favored 'General case' 0 C--N 1.3 -1.543 0 CA-C-N 114.144 -1.389 . . . . 75.230000000000004 111.288 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 44.3 m -107.54 149.36 28.09 Favored 'General case' 0 N--CA 1.412 -2.351 0 C-N-CA 119.559 -0.857 . . . . 65.030000000000001 109.948 -176.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' ILE . . . . . 0.664 HD11 ' SD ' ' A' ' 495' ' ' MET . 1.5 mt -122.08 141.47 42.36 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.936 0 N-CA-C 106.892 -1.522 . . . . 71.049999999999997 106.892 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -116.63 124.94 51.01 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 108.101 -1.074 . . . . 74.140000000000001 108.101 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.6 mt -108.88 125.46 52.02 Favored 'General case' 0 C--N 1.279 -2.483 0 N-CA-C 106.038 -1.838 . . . . 70.420000000000002 106.038 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -136.52 137.26 40.11 Favored 'General case' 0 C--N 1.274 -2.709 0 CA-C-O 121.32 0.581 . . . . 54.149999999999999 110.372 -176.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 95.08 23.0 21.36 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 110.279 -1.128 . . . . 61.539999999999999 110.279 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 98.9 mt -60.11 145.46 85.15 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 123.899 0.88 . . . . 72.409999999999997 111.932 -178.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -59.98 158.96 27.3 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 C-N-CA 122.836 2.357 . . . . 61.450000000000003 113.707 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -77.17 95.1 4.2 Favored 'General case' 0 N--CA 1.396 -3.161 0 CA-C-N 113.004 -1.907 . . . . 75.340000000000003 109.683 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . 87.74 26.84 0.04 OUTLIER 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 112.362 -2.199 . . . . 71.329999999999998 112.926 171.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' ALA . . . . . . . . . . . . . . . -67.55 136.2 54.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.579 -0.737 . . . . 60.020000000000003 109.228 173.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 5.8 p -85.68 151.9 23.51 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 115.663 -0.699 . . . . 74.450000000000003 109.574 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' ILE . . . . . 0.621 ' O ' ' HG ' ' A' ' 462' ' ' LEU 0.253 2.7 pp -62.3 -29.66 47.17 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.763 0 C-N-CA 120.003 -0.679 . . . . 73.340000000000003 112.606 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.86 -29.42 67.73 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.884 0.374 . . . . 70.420000000000002 111.224 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -75.51 -40.09 57.57 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.929 -0.767 . . . . 60.43 108.929 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' ILE . . . . . 0.443 HG22 ' HA ' ' A' ' 458' ' ' ILE . 12.4 tt -75.07 -28.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 C-N-CA 120.137 -0.625 . . . . 52.229999999999997 111.07 -179.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 458' ' ' ILE . 87.0 mt -63.62 -34.84 78.71 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.676 -0.49 . . . . 75.200000000000003 109.676 175.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.19 -48.54 70.33 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.341 -0.985 . . . . 72.329999999999998 108.341 176.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.74 -41.18 70.09 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 113.992 -1.458 . . . . 72.340000000000003 111.2 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 97.0 mt -69.65 -37.39 76.73 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.013 -0.539 . . . . 75.519999999999996 110.325 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' GLY . . . . . . . . . . . . . . . 87.29 -146.65 20.36 Favored Glycine 0 N--CA 1.418 -2.509 0 C-N-CA 120.758 -0.734 . . . . 63.240000000000002 112.97 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -49.75 -30.54 9.66 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 126.343 1.857 . . . . 73.040000000000006 113.275 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -61.62 -19.58 62.41 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.38 0.672 . . . . 72.510000000000005 112.368 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -61.9 -15.29 41.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.213 0.82 . . . . 72.420000000000002 113.213 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 12.8 t -86.58 -15.02 41.16 Favored 'General case' 0 CA--C 1.551 1.012 0 O-C-N 121.694 -0.629 . . . . 53.0 111.548 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . 0.403 ' HB3' ' CE ' ' A' ' 495' ' ' MET . 36.9 t70 -102.42 13.44 34.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.167 0.984 . . . . 51.299999999999997 110.469 -174.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 11.2 tt -73.53 152.62 7.31 Favored 'Isoleucine or valine' 0 C--O 1.248 1.013 0 CA-C-N 115.195 -0.911 . . . . 72.329999999999998 109.202 177.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -83.87 144.59 29.13 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 119.836 -0.745 . . . . 64.219999999999999 109.126 173.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 20.4 m -59.9 119.31 7.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.783 -0.821 . . . . 72.239999999999995 108.783 176.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 36.2 t-80 68.11 21.55 8.65 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.305 1.05 . . . . 64.239999999999995 109.257 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' GLY . . . . . . . . . . . . . . . -74.75 -15.99 80.5 Favored Glycine 0 N--CA 1.438 -1.176 0 CA-C-N 115.512 -0.767 . . . . 63.0 112.296 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 7.7 p -83.67 123.81 39.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.445 0.641 . . . . 62.43 110.404 178.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -133.24 117.12 17.02 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.674 -0.861 . . . . 74.109999999999999 108.674 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' MET . . . . . . . . . . . . . 63.0 mtt -91.87 145.5 24.5 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-O 120.676 0.274 . . . . 64.230000000000004 110.341 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' VAL . . . . . . . . . . . . . 64.9 t -84.61 96.33 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.545 0 N-CA-C 105.74 -1.948 . . . . 74.5 105.74 172.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.3 pp -96.03 161.42 13.99 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 114.209 -1.36 . . . . 71.319999999999993 113.356 -176.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.02 162.98 16.52 Favored 'General case' 0 C--N 1.282 -2.336 0 N-CA-C 104.098 -2.556 . . . . 71.239999999999995 104.098 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' HIS . . . . . . . . . . . . . 64.3 m80 -70.31 -5.16 25.92 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 119.788 1.176 . . . . 72.25 112.411 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -83.39 -7.02 59.63 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.073 -0.967 . . . . 75.310000000000002 109.143 172.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 81.29 29.15 41.68 Favored Glycine 0 CA--C 1.495 -1.218 0 CA-C-N 115.746 -0.661 . . . . 55.439999999999998 112.859 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -117.43 127.41 26.69 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 108.669 -0.863 . . . . 61.32 108.669 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.78 126.63 19.39 Favored 'Trans proline' 0 C--O 1.243 0.772 0 C-N-CA 122.347 2.032 . . . . 52.229999999999997 111.197 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 18.6 m -74.95 -2.14 25.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.892 -0.594 . . . . 71.400000000000006 112.068 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . 107.56 10.93 26.19 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.88 -0.676 . . . . 54.43 111.737 179.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -132.25 138.31 47.86 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.168 -1.419 . . . . 63.149999999999999 107.168 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -161.17 161.37 30.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.868 0.366 . . . . 45.109999999999999 110.73 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -122.9 142.81 50.39 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 123.3 0.64 . . . . 72.239999999999995 109.3 177.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 60.8 mt -128.62 126.5 65.37 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.228 0 N-CA-C 107.491 -1.299 . . . . 53.43 107.491 174.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -100.19 126.36 46.46 Favored 'General case' 0 C--N 1.275 -2.648 0 N-CA-C 109.539 -0.541 . . . . 51.310000000000002 109.539 177.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' MET . . . . . 0.664 ' SD ' HD11 ' A' ' 447' ' ' ILE . 82.9 mtp -100.47 170.38 8.43 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 108.364 -0.976 . . . . 74.439999999999998 108.364 177.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -80.82 -35.59 32.72 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.4 -0.592 . . . . 72.430000000000007 109.4 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 70.5 m -122.06 141.36 51.46 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-O 121.469 0.652 . . . . 73.129999999999995 111.205 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -76.18 -22.71 55.0 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.9 . . . . 71.439999999999998 111.84 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -70.97 -40.93 71.64 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.782 -0.644 . . . . 73.25 110.753 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -38.41 67.2 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.279 -0.873 . . . . 75.0 111.753 173.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . 0.418 ' HA ' ' SD ' ' A' ' 495' ' ' MET . . . -57.81 -44.73 86.54 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.196 0.522 . . . . 53.520000000000003 110.779 178.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -63.13 -39.2 94.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.631 -0.713 . . . . 70.209999999999994 110.426 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.85 -34.99 72.21 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.64 0.237 . . . . 75.040000000000006 111.64 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -67.15 -43.24 82.83 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.56 -0.533 . . . . 64.140000000000001 109.56 177.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 509' ' ' HIS . . . -66.45 -29.67 69.85 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.897 -0.592 . . . . 74.230000000000004 110.901 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -71.52 -44.69 64.17 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.458 -0.571 . . . . 63.299999999999997 109.458 177.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.2 -44.51 96.42 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.611 -0.722 . . . . 73.439999999999998 110.347 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' CYS . . . . . . . . . . . . . 58.9 m -98.71 10.44 41.14 Favored 'General case' 0 N--CA 1.421 -1.907 0 N-CA-C 113.513 0.931 . . . . 34.119999999999997 113.513 -173.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 505' ' ' ALA . 32.7 t60 -77.06 104.35 7.5 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 119.439 -0.904 . . . . 73.230000000000004 109.453 174.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 73.01 19.43 3.7 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.72 1.208 . . . . 74.430000000000007 110.617 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.02 146.67 26.55 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.502 -1.296 . . . . 70.010000000000005 107.502 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -98.04 149.52 22.38 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 118.666 -1.214 . . . . 75.200000000000003 111.673 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . . . . . . . . . 27.0 ttt -120.17 113.0 19.79 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 104.946 -2.242 . . . . 52.329999999999998 104.946 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 66.3 mttm 69.99 -87.19 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.118 -1.067 . . . . 72.329999999999998 108.118 -172.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.25 1.53 1.24 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.314 0.646 . . . . 74.409999999999997 111.417 175.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' ARG . . . . . . . . . . . . . 25.7 ttt180 -103.99 142.58 34.19 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 107.566 -1.272 . . . . 71.219999999999999 107.566 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -95.24 125.35 39.82 Favored 'General case' 0 C--N 1.265 -3.077 0 CA-C-O 121.489 0.661 . . . . 73.310000000000002 110.7 -176.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' VAL . . . . . . . . . . . . . 61.4 t -102.23 127.39 55.84 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.666 0 N-CA-C 106.881 -1.525 . . . . 72.200000000000003 106.881 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -103.77 109.21 20.84 Favored 'General case' 0 N--CA 1.411 -2.404 0 N-CA-C 108.221 -1.029 . . . . 75.439999999999998 108.221 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 97.0 t -106.73 134.28 48.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 CA-C-N 115.15 -0.932 . . . . 61.43 110.623 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -125.33 159.9 30.63 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.437 -0.949 . . . . 73.530000000000001 108.437 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' GLN . . . . . 0.657 ' NE2' ' HB2' ' A' ' 444' ' ' ARG . 1.0 OUTLIER -101.68 139.49 37.25 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.392 -1.336 . . . . 40.100000000000001 107.392 177.482 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' CYS . . . . . 0.403 ' N ' HE21 ' A' ' 522' ' ' GLN . 65.1 m -141.01 169.47 17.54 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.86 0.362 . . . . 62.409999999999997 110.724 -175.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 444' ' ' ARG . 14.3 p -99.2 159.96 14.61 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.999 -0.546 . . . . 62.43 109.931 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -56.99 -30.88 64.52 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 123.614 0.571 . . . . 63.409999999999997 109.646 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.36 -52.56 57.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.377 1.071 . . . . 55.039999999999999 110.068 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -59.68 -42.81 93.75 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.675 0.75 . . . . 73.340000000000003 109.076 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 528' ' ' MET . . . . . . . . . . . . . 22.1 ttt -62.01 -45.04 95.33 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 114.586 -1.188 . . . . 74.519999999999996 110.199 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.99 -39.3 87.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.938 -0.573 . . . . 65.420000000000002 109.761 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 530' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -68.31 -39.12 82.12 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.079 -0.509 . . . . 71.340000000000003 110.764 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 91.5 t -73.3 -38.11 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 C-N-CA 120.233 -0.587 . . . . 63.130000000000003 110.469 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 92.3 mt -75.15 -19.3 59.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.204 0.526 . . . . 70.230000000000004 111.772 -178.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' MET . . . . . . . . . . . . . 27.8 ttt -86.05 -4.08 59.09 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.669 0.747 . . . . 75.540000000000006 110.442 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 66.22 40.69 94.92 Favored Glycine 0 C--N 1.305 -1.171 0 N-CA-C 110.139 -1.184 . . . . 23.239999999999998 110.139 -176.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' GLY . . . . . . . . . . . . . . . -58.33 121.7 27.17 Favored Glycine 0 N--CA 1.411 -2.976 0 CA-C-N 114.556 -0.822 . . . . 60.420000000000002 114.175 -175.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 21.3 m -104.75 134.43 47.92 Favored 'General case' 0 C--N 1.269 -2.9 0 N-CA-C 105.797 -1.927 . . . . 72.040000000000006 105.797 175.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 4.3 tt -83.61 81.44 8.74 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 108.188 -1.042 . . . . 71.5 108.188 -177.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -108.5 83.59 1.8 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.733 -1.121 . . . . 74.319999999999993 108.218 178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -139.31 41.01 2.08 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.912 -1.514 . . . . 63.130000000000003 106.912 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 5.9 tt -86.5 121.84 29.61 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 113.331 -1.759 . . . . 70.099999999999994 108.378 -174.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 . . . . . 0 C--N 1.286 -2.195 0 N-CA-C 107.207 -1.405 . . . . 60.229999999999997 107.207 179.699 . . . . . . . . 0 0 . 1 stop_ save_